2,6-dimethylheptan-4-one

C9H18O

CAS108-83-8
GHS02 Gefahrensymbol: Entzündbar – Flamme
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
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Identification

CAS Number
108-83-8
EC Number
203-620-1
UN Number
1157
Index Number
606-005-00-X
PubChem CID
7958

Physical-chemical properties

Molecular Formula
C9H18O
Molar Mass
142.24 g/mol
IUPAC Name
2,6-dimethylheptan-4-one

Chemical Identifiers

InChI
InChI=1S/C9H18O/c1-7(2)5-9(10)6-8(3)4/h7-8H,5-6H2,1-4H3
InChI Key
PTTPXKJBFFKCEK-UHFFFAOYSA-N

Overview

2,6-dimethylheptan-4-one (CAS 108-83-8) is an organic ketone compound with flammable properties and industrial solvent applications. This branched aliphatic ketone features a seven-carbon chain with methyl substituents at positions 2 and 6, and a carbonyl group at position 4. With its molecular formula C9H18O and molecular weight of 142.24 g/mol, 2,6-dimethylheptan-4-one exhibits characteristic ketone functionality while maintaining structural similarity to other industrial solvents like 4-methylpentan-2-ol in terms of branched alkyl architecture. The compound is classified as a Category 3 flammable liquid under GHS regulations, requiring appropriate fire prevention measures during handling and storage. It also carries STOT SE 3 classification, indicating potential for specific target organ toxicity following single exposure. These safety considerations necessitate proper ventilation, personal protective equipment, and adherence to ADR Class 3 transportation requirements. As an organic solvent, 2,6-dimethylheptan-4-one finds applications in various industrial processes including paint and coating formulations, where its ketone structure provides effective solvency for resins and polymers. The compound also serves in chemical synthesis as an intermediate or reaction medium, particularly in processes requiring moderate polarity solvents. Additionally, it functions in specialty cleaning applications where its solvent properties prove advantageous for removing organic residues. The branched ketone structure offers distinct advantages over linear alternatives, providing improved performance characteristics in specific formulations. Its chemical stability and controlled reactivity make it suitable for processes requiring predictable solvent behavior. OYSI maintains reliable supply chains for 2,6-dimethylheptan-4-one, ensuring consistent availability for European industrial customers requiring this specialized ketone solvent.

Safety & Classification

Warning
Classification:

Flam. Liq. 3; STOT SE 3

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H226

Flammable liquid and vapour.

H335

May cause respiratory irritation.

Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).

First Aid Measures

Inhalation

Irritant

Measures if vapours or dust are inhaled

First Aid Actions

  • +P304IF INHALED:
  • +P340Remove person to fresh air and keep comfortable for breathing.
  • +P311Call a POISON CENTER/doctor.

Related hazard statements:

General Measures

Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)

First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.

Transport (ADR)

UN Number1157
ADR Class3
Packing GroupIII
Tunnel CodeD/E
Proper Shipping NameDiisobutylketon
Marine PollutantNo

Frequently Asked Questions

What is 2,6-dimethylheptan-4-one?

2,6-dimethylheptan-4-one is an organic ketone compound with the molecular formula C9H18O and CAS number 108-83-8. This branched aliphatic ketone has a molecular weight of 142.24 g/mol and features a seven-carbon chain with methyl substituents at positions 2 and 6, and a ketone functional group at position 4. It is classified as a flammable liquid and may cause specific target organ toxicity following single exposure.

What are the physicochemical properties of 2,6-dimethylheptan-4-one?

2,6-dimethylheptan-4-one is a colorless to pale yellow liquid at room temperature with a characteristic ketone odor. As a branched aliphatic ketone with molecular formula C9H18O, it has limited water solubility but is miscible with most organic solvents including alcohols, ethers, and hydrocarbons. The compound exhibits typical ketone reactivity and has a relatively low vapor pressure due to its branched structure.

What is 2,6-dimethylheptan-4-one used for?

2,6-dimethylheptan-4-one is primarily used as a solvent in industrial applications and as an intermediate in organic synthesis. Its ketone functionality makes it valuable for chemical manufacturing processes, particularly in the production of specialized chemicals and pharmaceuticals. The compound may also serve as a flavoring agent in food applications and as a fragrance component, though these uses require specific purity grades and regulatory compliance.

How to handle 2,6-dimethylheptan-4-one safely?

2,6-dimethylheptan-4-one requires careful handling as a flammable liquid (Class 3). Workers must wear appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing. Ensure adequate ventilation to prevent vapor accumulation, eliminate ignition sources, and use grounded equipment to prevent static electricity buildup. The compound may cause specific target organ toxicity, so minimize exposure through proper engineering controls and respiratory protection when necessary.

How to store 2,6-dimethylheptan-4-one correctly?

2,6-dimethylheptan-4-one must be stored in a cool, dry, well-ventilated area away from heat sources, sparks, and open flames due to its flammable nature. Use appropriate containers made of compatible materials and ensure proper grounding of storage vessels. Keep away from strong oxidizing agents and incompatible materials. Storage areas should comply with local fire safety regulations for flammable liquids and maintain temperatures below the compound's flash point.

What to do in case of contact with 2,6-dimethylheptan-4-one?

In case of skin contact with 2,6-dimethylheptan-4-one, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water for at least 15 minutes. For eye contact, flush immediately with clean water for 15-20 minutes and seek medical attention. If inhaled, move the person to fresh air and seek medical advice if symptoms persist. For ingestion, do not induce vomiting and seek immediate medical attention.

How to dispose of 2,6-dimethylheptan-4-one properly?

2,6-dimethylheptan-4-one must be disposed of as hazardous waste in accordance with local and national regulations. Contact licensed waste disposal companies specialized in handling flammable organic solvents. Never pour the substance down drains or into the environment. Small quantities may be incinerated at authorized facilities with appropriate emission controls. Ensure proper documentation and waste tracking as required by applicable waste management legislation in your jurisdiction.

How to transport 2,6-dimethylheptan-4-one?

2,6-dimethylheptan-4-one is classified under ADR as Class 3 (flammable liquids), Packing Group III. Transport requires appropriate UN-approved packaging and proper labeling with flammable liquid hazard signs. Vehicles must comply with ADR requirements including proper ventilation, grounding, and emergency equipment. Drivers need ADR certification for dangerous goods transport. Ensure proper documentation including transport documents and emergency response information during shipment.

Is 2,6-dimethylheptan-4-one subject to specific regulations?

2,6-dimethylheptan-4-one is subject to standard chemical regulations including REACH registration requirements in the European Union and CLP classification as a flammable liquid with specific target organ toxicity. The substance is not currently listed as an SVHC (Substance of Very High Concern). Users must comply with workplace safety regulations, proper labeling requirements, and safety data sheet provisions. Industrial users may need to fulfill notification requirements depending on usage volumes and applications.

Where to buy 2,6-dimethylheptan-4-one in Europe?

2,6-dimethylheptan-4-one is available through OYSI, a trusted European distributor of specialty chemicals. OYSI provides reliable supply chains across Europe with proper documentation, safety data sheets, and regulatory compliance support. As an established chemical distributor, OYSI ensures quality products meeting industrial specifications and can assist with technical support, logistics, and regulatory guidance for your specific application requirements throughout European markets.

Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.