Wusu, Tacheng Prefecture, Xinjiang, China admin@sinochem-nanjing.com 3389378665@qq.com
Follow us:



3,4-Dimethylheptane: A Practical Perspective

Historical Development

Chemistry always finds a way to surprise me with its depth and the stories behind even straightforward hydrocarbons. 3,4-Dimethylheptane first caught attention in the mid-20th century, a period when both organic syntheses and fuel research took off. Researchers, eager to optimize fuel performance, scouted for branched alkanes to study their combustion characteristics. By the time synthetic methods advanced through the 1950s, chemists could create alkane isomers like this one with much more intention. Gasoline development really made compounds like 3,4-Dimethylheptane more important than the textbooks sometimes let on—each new branch on an alkane chain changed volatility, knocking resistance, and even the environmental behavior of a product. This example isn’t flashy, but it offers a window into the shift from accidental discovery to deliberate design in organic chemistry.

Product Overview

No commercial product shelf would feature 3,4-Dimethylheptane as a standalone retail item, but its presence in laboratories and petrochemical plants shows real value. The molecule belongs to the family of branched-chain alkanes, with the formula C9H20. Its stable structure, resistance to oxidation under ordinary conditions, and predictable thermal behavior make it more than just another scientific curiosity. I’ve seen it referenced as a reference standard in quality control labs and noted as a marker for calibration during chromatographic analysis. Technicians don’t reach for this hydrocarbon for flavor or color. Instead, it fits into a routine of scientific rigor and industrial necessity, humming along quietly while global energy and manufacturing engines run.

Physical & Chemical Properties

If you’ve ever handled straight-chain and branched alkanes, you’ll recognize 3,4-Dimethylheptane by its distinct lack of drama—clear, non-polar, with a melting point below room temperature and only slightly higher boiling point than similar isomers. It floats on water, refuses to dissolve in it, and evaporates if left exposed. In chromatographic separation, it lands in predictable places, making it a reference point for analytical procedures. Compared to its linear cousins, the extra methyl branches produce slightly lower density and boiling point due to weaker intermolecular forces. Not much of a smell, certainly nothing alarming, but unmistakable to a trained chemist’s nose. Properties like these might sound unremarkable, yet they carve out a role in labs that can’t afford surprises.

Technical Specifications & Labeling

Labs and suppliers stick to clear conventions for labeling: the name "3,4-Dimethylheptane," possible mention of CAS number 1730-78-5, and purity ranging from analytical standard to technical grade, depending on the intended use. Chemists look for specific gravity and refractive index, especially where calibration and quality control are concerned. Precise labeling reflects the realities of technical jobs rather than abstract ideals. If the container sits in a fume hood or stockroom, it bears hazard pictograms, not out of excessive caution but for real-world clarity and lab safety. Unambiguous labeling, in my experience, stops misunderstandings before they start. Purity, storage conditions (like cool, dry, away from ignition sources), and the batch traceability round out the practical information—much like any solvent or hydrocarbon with industrial use.

Preparation Method

Chemists reach for catalytic alkylation to assemble branched alkanes like 3,4-Dimethylheptane. This approach involves adding methyl groups to a heptane backbone in a controlled environment. Industrial-grade syntheses employ aluminum chloride or other Lewis acids to direct alkylation where desired, while academic approaches sometimes feature organometallic reagents for selectivity. The method relies less on rare precursors and more on careful distillation, purification, and verification steps. You can feel the hand of human ingenuity at every stage—balancing yield, selectivity, and practicality rather than always chasing the most elegant reaction. The process doesn’t dazzle, but steadiness often trumps flashiness where scale and reliability count. Any chemical worker who’s ever waited for a distillation column to finish can tell you: even the most humble product depends on careful, often invisible labor.

Chemical Reactions & Modifications

Branched alkanes seldom leap into reactivity; 3,4-Dimethylheptane stands as a case in point. It largely resists acids, bases, and most oxidizers unless exposed to harsh conditions. Cracking under high heat and pressure, as seen in oil refineries, breaks it into smaller hydrocarbons—fuel for other reactions or refinery streams. Chlorination, mostly in academic settings, can yield chloro derivatives, but controlling these reactions gets tricky due to the mixture of products. Industrial settings rarely favor alkane modification for this reason; usefulness often lies in the unaltered molecule. If you aim for higher reactivity, you can introduce functional groups by radical halogenation, but you trade selectivity for unpredictability. The stability of 3,4-Dimethylheptane lets researchers focus on controlled studies rather than damage control, an underrated plus in laboratory safety and research consistency.

Synonyms & Product Names

3,4-Dimethylheptane, as its name implies, features two methyl groups at the third and fourth positions on a heptane backbone. Some texts and chemical catalogs refer to it as Heptane, 3,4-dimethyl- or as dimethylnonane, reflecting variations in nomenclature standards over the years. The CAS number, 1730-78-5, clears up any ambiguity in supply chain transactions. I’ve heard it called a C9-alkane in fuel research circles, since shorthand gets the job done when running equipment or analyzing engine tests. Synonyms change with language and context, but clear labeling ensures the molecule remains unambiguous, no matter how many different labs handle it.

Safety & Operational Standards

No hydrocarbon escapes fire risk, and 3,4-Dimethylheptane is no exception. Flammability demands proper storage, with metal cans or high-density polyethylene containers kept away from sparks or flames. Laboratories and refineries focus on local ventilation, spill management, and grounded containers during transfers. Inhalation, despite this alkane’s low volatility, can irritate airways, and prolonged skin exposure may cause dryness or irritation. Safety data sheets spell out first-aid measures without drama: fresh air, soap, and medical evaluation if symptoms persist. Environmental release concerns spill cleanup and containment, since the vapor can travel along surfaces or form ignitable mixtures with air. First responders benefit from clear training, but everyday chemical workers often develop their own sense of caution born from routine and repetition. In my own lab days, we relied on these routines, never skipping steps, since even the tamest chemicals can surprise the unwary.

Application Area

3,4-Dimethylheptane finds its strongest utility as a reference standard in analytical chemistry, especially in gas chromatography. Analytical labs value its predictable retention time and chemical stability. In the context of petroleum testing, the compound can indicate refinery process efficiency or serve as part of a suite of standards to test gasoline formulations. Everyday drivers might never hear the name, but the fuel in their tanks benefits from standard mixtures including such branched alkanes. Research settings also deploy it to simulate real-world hydrocarbon mixtures, helping scientists trace pathways for combustion, pollution, or breakdown. Academic circles explore the molecule as part of broader studies on structure-activity relationships, teaching students and professionals the subtle ways chemical structure tunes performance in fuels and lubricants.

Research & Development

R&D teams rarely single out 3,4-Dimethylheptane for blockbuster innovation, but it features regularly in studies exploring fuel efficiency, octane rating, and environmental impact. Its place in reference data sets supports computational chemistry efforts to predict fuel behavior and emission patterns. Modern research, armed with quantum chemical calculations, builds models of fuel combustion based on small molecules like this. Standardization of testing procedures rests on reproducible results using such benchmarks. I’ve seen colleagues engaged in iterative tuning of refinery processes, measuring the impact of gentle changes in hydrocarbon composition—small steps toward cleaner, more efficient combustion. 3,4-Dimethylheptane seldom wins headlines, but it keeps these big-picture goals grounded in rigorous data.

Toxicity Research

The search for toxicity data on simple alkanes usually turns up relatively low acute toxicity, but questions remain about long-term exposure and environmental persistence. Like most hydrocarbons in gasoline, 3,4-Dimethylheptane earns scrutiny for inhalation risks and potential for central nervous system effects after sustained high exposures. Animal studies suggest the bulk of low-molecular-weight alkanes pass through the body rapidly, but the unanswered questions push tox researchers to keep checking for subtle impacts. Regulatory focus falls on flammability and environmental release, since large spills can suffocate aquatic life and contribute to air pollution. Industrial hygiene protocols build in safeguards, but new research continues, especially as analytical techniques let scientists trace small molecules through air, water, and soil.

Future Prospects

Looking ahead, 3,4-Dimethylheptane’s role links directly to the evolution of energy, environmental sustainability, and analytical chemistry. As regulations on fuel composition tighten and advanced engines demand more from every drop of gasoline, reference compounds like this one grow more relevant. Clean fuel standards depend on robust measurements and traceability, and so steady supplies and rigorous standards for such molecules will likely expand. In the longer view, efforts to develop alternative fuels and understand urban pollution will keep researchers coming back to branched alkanes, which shape combustion efficiency and pollutant formation. The hydrocarbon itself may not change, but its utility grows as technology and science advance—proving that even the most unassuming molecules can play crucial roles far beyond the laboratory bench.




What is 3,4-Dimethylheptane used for?

An Overlooked Hydrocarbon in Plain Sight

Say “3,4-Dimethylheptane” in a room, and someone probably thinks you’re throwing around jargon from a chemistry class. In reality, this chemical sits right alongside familiar names in the vast world of industrial hydrocarbons. While it doesn’t grab headlines like propane or octane, it still plays a quiet but sturdy role in several industrial routines. Lab work introduced me to the background players of chemistry, and this one caught my eye. Digging deeper, its importance in daily industry comes into sharper focus.

The Fuel Angle: Something Beyond the Mainstream

Fuel formulas shape what keeps engines humming. 3,4-Dimethylheptane, like other branched alkanes, slides into fuel blends to tweak the octane rating. Higher octane means smoother engine performance and fewer knocks. Gasoline blends carry a mix of hydrocarbons, and chemists look for molecules that burn clean and resist knocking. During a refinery internship, I saw tests run with different alkane mixtures. Sometimes blends leaned on straight-chained versions; other times, branched versions like 3,4-Dimethylheptane stepped in to boost reliability. It’s not the hero, but it nudges performance in the right direction.

Behind the Scenes in the Lab

Lab workers treat hydrocarbons such as 3,4-Dimethylheptane as reference points. They calibrate instruments or validate results using well-defined chemicals. For example, the oil and gas industry tests how complex mixtures behave under pressure and temperature. Having something pure and stable on hand grounds those results. In my lab work, reference chemicals avoided surprises by providing baseline readings. Lots of these compounds never touch consumer shelves, but their steady presence in scientific work lets industries troubleshoot, standardize, and move forward with confidence.

Safety and Health Realities

Hydrocarbon vapors get flammable fast. I remember safety briefings that emphasized never treating these chemicals lightly just because they seem familiar. 3,4-Dimethylheptane doesn’t cause immediate alarm, but repeated exposure calls for common-sense precautions. Industries should keep strong ventilation in work areas and proper storage containers ready. With enough respect for safety protocols, workers cut down on accidents and exposure-related health issues. Sticking to safety checklists sounds dull, but nothing sets you straight like seeing a lab mishap from a careless spill.

Environmental Considerations

Fossil fuel-based chemicals leave a mark outside the lab too. 3,4-Dimethylheptane forms part of emissions if incomplete combustion takes place. Reducing pollution calls for more than just switching to electric vehicles—scrutiny falls on what goes into the tank in the first place. During college, road trips usually meant filling up without a second thought. These days, I ask what’s in the fuel, because every extra branched alkane means a slightly cleaner-running car, especially if engines burn efficiently. Regulations keep tightening, pushing refineries to balance performance and lower emissions with each blend they produce.

Looking Ahead for Improvements

As refineries adopt better tech, researchers keep searching for safer, less polluting hydrocarbons. Advanced monitoring tools detect and minimize leaks before they become hazards. Teach chemistry at any level, and you’ll see students grow skeptical about what makes fuel “better.” Facts show improvements rarely come from just one big change but from steady practice, right down to the obscure molecules like 3,4-Dimethylheptane. Pushing for cleaner, more efficient fuel blends with close attention to unseen chemicals marks a solid move forward for both industry and health.

What is the chemical formula of 3,4-Dimethylheptane?

Breaking Down the Name

Names in organic chemistry can feel intimidating. Let’s work through it. “Heptane” gives away a lot: seven carbon atoms line up in the longest chain. “3,4-Dimethyl” points to two side branches—both methyl groups (single carbon units) attached at the third and fourth spots of that main chain. So, lay out seven carbons in a row, then add a single carbon to the third and fourth carbons. This sort of molecular labeling helps chemists, students, and industry workers keep compounds straight both in the lab and on paper.

Why Structure Matters

The layout of atoms in molecules influences everything from boiling point to how a chemical behaves in your car engine or a refinery. Adding the methyl groups to different locations makes a big difference. Isomers, which are molecules with the same formula but different structures, have unique properties. One could light up an engine with more power, another might evaporate more easily, and some could even have regulatory restrictions. In teaching, I often saw students struggle, thinking all molecules with the same elements behave the same. In reality, chemical structure means just as much as the numbers.

Finding the Formula

With the base as heptane (C₇H₁₆), each methyl group brings one more carbon and three hydrogens. Yet, simply tacking them on would overcount hydrogens since attaching a new branch drops a hydrogen from the main chain. I always suggest drawing it out: count out the carbons, then fill any remaining spots on each carbon with hydrogens until each carbon has four bonds.

For 3,4-dimethylheptane, there are nine carbons total—seven in the main chain and one at each methyl branch. To ensure accuracy, check each carbon’s bonding. The final tally lands at C₉H₂₀. It looks straightforward, but working it out instead of relying on memory avoids mistakes, especially in chemistry exams or industrial settings where the wrong formula could lead to hazards or wasted resources.

Real-Life Value

I once visited a refinery that manufactured fuel additives. Workers there stressed that even a minor side chain change transforms properties. Mistaking 3,4-dimethylheptane for another isomer could affect flammability, storage requirements, and blend quality. In safety protocols, exact formula matching also keeps everyone safe. Toxicity, volatility, and environmental impact all depend on structure, not just the story told by the numbers “C₉H₂₀.”

Choosing precise language in chemistry prevents errors. Using full names like “3,4-dimethylheptane” makes a difference. As we look to newer fuels and greener practices, understanding and communicating the detailed structure of molecules allows for better design and safer handling.

Solutions for Clarity and Accuracy

Keeping chemical drawings and naming systems handy helps everyone: students, scientists, and suppliers. Visuals boost understanding, so educators and team leads should encourage drawing—just as much as memorization. Digital tools now analyze molecular names in seconds, helping laboratories double-check their work. Regular refresher training reduces mislabeling and builds confidence with tricky molecules. Some companies post molecular structure charts in work areas to lower error risk. Ultimately, sticking to rigorous educational and industrial protocols keeps workplaces safe and moves science forward.

Quick Reference

For anyone searching or double-checking: the chemical formula of 3,4-dimethylheptane is C₉H₂₀.

Is 3,4-Dimethylheptane hazardous or toxic?

Digging Into 3,4-Dimethylheptane’s Real-World Risks

People hear “chemical” and worry. Let’s talk honestly about 3,4-Dimethylheptane. This compound belongs to the family of alkanes—think of it as one of those hydrocarbons found in fuels and lubricants. If you’ve worked in a garage, refinery, or even handled gasoline, you’ve brushed up against substances like this.

Most folks don’t realize how much chemistry shapes daily life. Alkanes, for the most part, behave predictably. 3,4-Dimethylheptane doesn’t set off alarms like benzene, which gets a bad rap for causing cancer. Its structure keeps it relatively stable, meaning it’s not likely to react unpredictably with stuff you might have at home or work. That’s not a pass to toss safety out the window.

What Happens If You Breathe, Swallow, or Touch It?

If you manage a warehouse or keep a workshop running, inhaling vapors from alkanes isn’t rare. Breathing in too much 3,4-Dimethylheptane vapor—it can make your head spin, trigger dizzy spells, or even set off nausea. These effects don’t feel life-shattering, but long exposure in poorly ventilated spots has sent folks to the ER before, mostly from bigger doses.

Spilling this liquid on bare skin rarely leaves a mark, though it can dry your hands out, sometimes to the point of cracking. Swallowing pure 3,4-Dimethylheptane won’t do your stomach any favors either. Like guzzling lighter fluid, it doesn’t belong inside the human body. Animal studies show a limit to how much mammals can handle, but serious poisoning takes a large amount—a scenario most won’t face unless working with it carelessly.

Fire, Fumes, and Handling with Care

This chemical burns easily. One spark near a leaky drum spells trouble. My years spent around maintenance sheds drilled one lesson into my head: treat any highly flammable liquid with respect. Vapors from 3,4-Dimethylheptane, like gasoline, can ignite fast and spread flames.

Exposure to burning alkanes brings its own risk, too. Fumes can irritate your respiratory tract and make breathing tough, especially in a closed space. Fire safety isn’t just a checklist—good training keeps accidents from turning deadly.

Why It Matters: Worker Safety and Environmental Health

Employers who look after staff get more than just compliance—they earn trust. Mandating gloves, splash-proof goggles, and proper ventilation goes a long way. Store this stuff in tightened containers, away from sparks, with easy access to fire extinguishers.

Spills need swift cleaning to keep it from soaking into soil or washing into storm drains. Alkanes don’t break down fast in the environment; they hang around, building up in ways that threaten wildlife. Trained crews do better when they drill on these tasks, because preparation lowers the odds of ugly surprises.

Building Better Habits with Information

No need to demonize every chemical; most stay safe with a little common sense. The science tells us to pay attention—organizations like the CDC and OSHA spell out limits for exposure. Keeping up with the latest safety data sheets makes sure you aren’t working on guesswork.

Armed with good information, people on the job can ask better questions and spot trouble before small issues grow out of control. That keeps teams healthy and companies running, without shortcuts or scare tactics.

How should 3,4-Dimethylheptane be stored?

Understanding Why Storage Matters

3,4-Dimethylheptane isn’t a household staple, but in industries where it plays a role—think laboratories, chemical plants, and fuel research—storage isn’t some background detail. Mishandling nearly always leads to hazards. This compound belongs to the hydrocarbon family and shows many similarities to other alkanes: it’s colorless, produces a noticeable odor, and isn’t something you’d want spilling onto the floor.

Fires and health scares caused by poorly stored solvents remind us why diligence is more than policy—it's about daily vigilance. According to the National Fire Protection Association, hydrocarbons regularly rank among the top culprits in chemical-related industrial fires. Their high volatility and low flash points serve as constant reminders that ordinary rooms or stockrooms just don't cut it for chemical storage.

The Right Environment

Growing up near a refinery, I saw first-hand how storage bleeds into community safety. Tanks housing chemicals like 3,4-Dimethylheptane stood isolated, behind fences, far from population centers. That’s not just local caution. Safety sheets from the American Chemical Society echo those measures. Proper storage starts with a cool, dry, well-ventilated space. Sunlight raises the temperature of organic solvents rapidly, and if you’ve ever touched a warm drum after a sunny afternoon, you’ll know the risk isn’t theoretical.

Keep oxidizers far away. Mixing hydrocarbons and oxidizers accelerates aging in barrels and, if a leak occurs, ramps up the fire risk. Even steel cabinets designed for flammables can’t do all the work if folks introduce unknowns into shared lockers. Many accidents stem from incompatible chemicals thrown together during warehouse cleanouts or relocations.

Labeling and Containment

A bottle of 3,4-Dimethylheptane shouldn’t blend in with other clear liquids. Labeling must be sharp—nothing fancy required, just a chemical name, date received, and hazard warnings. This helps both regular staff and emergency responders. In shared lab spaces during college, we saw red-taped shelves for flammables, and the system only worked if everyone kept things in their spot. Small steps like these kept us accident-free, even with frequent personnel changes.

You want containers tightly sealed, ideally made of materials that won’t degrade upon contact. Stainless steel and approved plastics top the list. Store on low shelves or secondary spill trays, never right up against the wall or in aisles. A containment breach—say, a dropped bottle—shouldn’t travel across half the storage room.

Ventilation and Monitoring

Anyone who’s breathed in solvent vapors understands the discomfort right away. Room fans or open doors can’t match purpose-built ventilation. Air should circulate outwards, filtered before release. Personal protective equipment comes into play when transferring from drums to smaller lab containers. Fume hoods become more than fixtures; they guard against accidental inhalation and buildup.

Regular inspections catch leaks early. Safety audits—sometimes seen as busywork—pay off by uncovering worn gaskets and rusting caps. I’ve seen teams save thousands of dollars and avoid near-misses by finding trouble spots during simple walkarounds. These checks also help organizations stay on the right side of tightening federal and state chemical regulations.

Looking Ahead

Safer storage practices for 3,4-Dimethylheptane don’t mean huge overhauls. Routine care, clear communication, reliable containment, and active monitoring act as the primary defense lines. Seeing storage as an ongoing responsibility makes a profound difference in both immediate safety and long-term community trust.

What are the physical properties of 3,4-Dimethylheptane?

What Science Shows About Structure

3,4-Dimethylheptane stands as a hydrocarbon, shaped by a seven-carbon chain and two methyl groups sticking to the third and fourth carbon atoms. As a member of the alkane family, it carries a simple formula: C9H20. Scientists call its structure “branched,” which plays a role in how the molecule interacts with its environment. The extra methyl groups set it apart from plain heptane, tweaking properties like boiling point and density.

Melting and Boiling Points – A Real-World Take

Pure 3,4-Dimethylheptane melts around -91°C and boils at about 148°C. Anyone working with fuels or chemical feedstocks needs to know these numbers. Cold storage or extreme temperature work both ask for chemicals with reliable melting and boiling points. 3,4-Dimethylheptane fits best in mid-range temperature jobs, where neither the risk of freezing nor early evaporation throws a wrench in the gears. Its boiling point puts it in the same neighborhood as other octanes and nonanes—slightly higher than heptane due to extra branching, but lower than straight nonane.

Density and Solubility – More Than Numbers

Its density usually settles near 0.72 grams per cubic centimeter at 20°C. In practice, that tells me a liter weighs less than water—oil refiners or chemists can use this difference to separate it from denser compounds. Like its alkane cousins, 3,4-Dimethylheptane does not mix with water but blends easily with other organics. Try pouring it into a beaker of water, and it’ll float and refuse to dissolve—standard fare for hydrocarbons. This feature makes cleanup easier during spills, as it can be skimmed off with the right equipment.

Viscosity and Volatility – Handling and Storage

3,4-Dimethylheptane carries low viscosity, running almost as smoothly as gasoline. Anyone working with pumps, valves, or small engines might see fewer blockages or buildup. Its volatility brings a flammable vapor risk, much like other members of the alkane family. If you store or transfer it, open flames and sparks spell trouble. I’ve seen colleagues get complacent with hydrocarbons like this—rigorous ventilation and strict static controls stand as non-negotiable safety basics.

Color, Odor, and Practicality

Most pure 3,4-Dimethylheptane shows up colorless and clear, carrying a faintly sweet odor, a reminder that it’s produced alongside many other hydrocarbons in petroleum processing. Its lack of color and minimal smell can make small leaks hard to notice. Good practices call for sensors or regular system checks, especially in busy refineries or labs.

Potential Solutions for Common Challenges

Handling and storing any volatile hydrocarbon brings a short list of core concerns: fire risk, inhalation hazards, and environmental clean-up. Strong training and proper gear form the front line. For companies using 3,4-Dimethylheptane as part of complex mixtures—like fuels or specialty chemicals—automated systems reduce spills and error. Investing in leak detection not only guards health and safety but can save money on lost product.

Why Physical Properties Can’t Be Ignored

Every time 3,4-Dimethylheptane enters a tank or lab, its physical properties step to the front. The density, boiling and melting points, and flammability all shape how workers use it, design equipment, and prevent accidents. These numbers aren’t just for reference books—they influence day-to-day safety, costs, and results.

3,4-Dimethylheptane
3,4-Dimethylheptane
3,4-Dimethylheptane
Names
Preferred IUPAC name 3,4-Dimethylheptane
Other names Heptane, 3,4-dimethyl-
3,4-Dimethyl-n-heptane
Pronunciation /ˈθriːˌfɔːr daɪˈmɛθɪl ˈhɛpteɪn/
Identifiers
CAS Number 17301-29-6
3D model (JSmol) `JSME:CC(C)CC(C)CCC`
Beilstein Reference 1238731
ChEBI CHEBI:141561
ChEMBL CHEMBL155921
ChemSpider 172333
DrugBank DB14057
ECHA InfoCard 22-2119957350-45-0000
EC Number 20887-32-5
Gmelin Reference 78684
KEGG C02638
MeSH D018385
PubChem CID 11580
RTECS number MI5950000
UNII A0D7Q8790Q
UN number UN3295
CompTox Dashboard (EPA) DJ60TQ6A5H
Properties
Chemical formula C9H20
Molar mass 128.255 g/mol
Appearance Colorless liquid
Odor Odorless
Density 0.730 g/mL at 25 °C
Solubility in water Insoluble in water
log P 4.79
Vapor pressure 0.947 mm Hg (at 25 °C)
Acidity (pKa) pKa ≈ 50
Magnetic susceptibility (χ) -74.99×10⁻⁶ cm³/mol
Refractive index (nD) 1.402
Viscosity 0.679 mPa·s (25 °C)
Dipole moment 0.00 D
Thermochemistry
Std molar entropy (S⦵298) 362.4 J·mol⁻¹·K⁻¹
Std enthalpy of formation (ΔfH⦵298) -241.8 kJ/mol
Std enthalpy of combustion (ΔcH⦵298) -4887.7 kJ/mol
Pharmacology
ATC code
Hazards
GHS labelling GHS labelling: Not a hazardous substance or mixture according to the Globally Harmonized System (GHS)
Pictograms GHS02
Precautionary statements P210, P233, P240, P241, P242, P243, P261, P271, P301+P310, P303+P361+P353, P304+P340, P331, P370+P378, P403+P235, P405, P501
NFPA 704 (fire diamond) 1-3-0
Flash point 54°C
Autoignition temperature 205 °C
Explosive limits Explosive limits: 1.1–6.5%
Lethal dose or concentration LD50 (oral, rat): > 5000 mg/kg
NIOSH NT8050000
PEL (Permissible) Not established
REL (Recommended) 5 ppm
Related compounds
Related compounds Hexane
Heptane
2,3-Dimethylpentane
2,4-Dimethylhexane
3-Methylheptane
2,3,4-Trimethylpentane