Pentan-2-yl acetate

C7H14O2

pentan-2-yl acetate

CAS626-38-0
GHS02 Gefahrensymbol: Entzündbar – Flamme
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Identification

CAS Number
626-38-0
EC Number
210-946-8
UN Number
1104
Index Number
607-130-00-2
PubChem CID
12278

Physical-chemical properties

Molecular Formula
C7H14O2
Molar Mass
130.18 g/mol
IUPAC Name
pentan-2-yl acetate

Chemical Identifiers

InChI
InChI=1S/C7H14O2/c1-4-5-6(2)9-7(3)8/h6H,4-5H2,1-3H3
InChI Key
GQKZRWSUJHVIPE-UHFFFAOYSA-N

Overview

Pentan-2-yl acetate (CAS 626-38-0) is an organic ester compound with flammable properties and characteristic fruity odor. This secondary acetate ester, with the molecular formula C7H14O2 and molecular weight of 130.18 g/mol, represents an important class of volatile organic compounds widely utilized in industrial applications. The compound is formed through the esterification reaction between acetic acid and pentan-2-ol, resulting in a colorless liquid with distinctive aromatic properties. Its chemical structure features a pentyl chain with the acetate group attached to the second carbon position, distinguishing it from primary acetate esters. From a safety perspective, pentan-2-yl acetate is classified as a Category 3 flammable liquid under GHS regulations, requiring appropriate handling precautions including adequate ventilation and ignition source control. The substance carries the warning signal word and GHS02 flame pictogram, indicating moderate fire hazard potential. Transportation falls under ADR Class 3 regulations for flammable liquids, necessitating proper packaging and documentation for shipping purposes. The compound finds primary application in the formulations industry as a solvent component, particularly in coatings, inks, and adhesive systems where its moderate volatility and solvency characteristics prove advantageous. Its aromatic properties also make it valuable in fragrance and flavoring applications, where it contributes fruity notes to consumer products. Similar to other acetate esters like 1-methoxypropan-2-yl acetate, it demonstrates excellent compatibility with various organic systems while maintaining favorable evaporation rates. OYSI maintains reliable supply chains for pentan-2-yl acetate, ensuring consistent availability for European industrial customers requiring this specialized ester compound for their manufacturing processes.

Safety & Classification

Warning
Classification:

Flam. Liq. 3

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H226

Flammable liquid and vapour.

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

Transport (ADR)

UN Number1104
ADR Class3
Packing GroupIII
Tunnel CodeD/E
Proper Shipping Name2-Pentylacetat
Marine PollutantNo

Frequently Asked Questions

What is pentan-2-yl acetate?

Pentan-2-yl acetate is an organic chemical compound with the molecular formula C7H14O2 and CAS number 626-38-0. It belongs to the ester family, formed by the reaction between acetic acid and pentan-2-ol. With a molecular weight of 130.18 g/mol, this colorless liquid exhibits typical ester characteristics and is classified as a flammable liquid under safety regulations.

What are the physicochemical properties of pentan-2-yl acetate?

Pentan-2-yl acetate is a colorless liquid with a pleasant, fruity odor characteristic of acetate esters. It has limited solubility in water due to its organic nature but is miscible with most organic solvents including alcohols and hydrocarbons. The compound has a density lower than water and exhibits moderate volatility at room temperature, contributing to its distinctive aroma.

What is pentan-2-yl acetate used for?

Pentan-2-yl acetate is primarily used as a solvent in various industrial applications including coatings, paints, and varnishes. It serves as a flavoring agent in the food industry due to its pleasant fruity aroma, and finds applications in the fragrance industry for perfumes and cosmetics. The compound is also utilized in chemical synthesis processes as an intermediate or reaction medium.

How to handle pentan-2-yl acetate safely?

Pentan-2-yl acetate requires careful handling due to its flammable nature (Flam. Liq. 3 classification). Use appropriate personal protective equipment including safety goggles, chemical-resistant gloves, and protective clothing. Ensure adequate ventilation to prevent vapor accumulation and avoid ignition sources. Work in well-ventilated areas away from heat, sparks, and open flames to minimize fire risk.

How to store pentan-2-yl acetate correctly?

Pentan-2-yl acetate should be stored in tightly sealed containers in a cool, dry, well-ventilated area away from heat sources and ignition sources. Keep containers away from incompatible materials such as strong oxidizing agents and acids. Storage areas should be equipped with appropriate fire suppression systems and maintained at temperatures below 25°C to prevent vapor buildup and degradation.

What to do in case of contact with pentan-2-yl acetate?

In case of skin contact with pentan-2-yl acetate, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water. For eye contact, rinse immediately with plenty of clean water for at least 15 minutes. If inhaled, move the person to fresh air immediately. Seek medical attention if irritation persists or if large quantities have been ingested.

How to dispose of pentan-2-yl acetate appropriately?

Pentan-2-yl acetate must be disposed of according to local and national hazardous waste regulations. Do not pour down drains or dispose of with regular waste due to its flammable nature. Contact licensed waste disposal companies for proper collection and treatment. Small quantities can often be recovered through solvent recovery processes, while larger volumes require specialized incineration in approved facilities.

How to transport pentan-2-yl acetate?

Pentan-2-yl acetate is classified under ADR Class 3 (flammable liquids), Packing Group III for transport purposes. It must be packaged in UN-approved containers with appropriate hazard labels including the GHS02 flame pictogram. Transport vehicles must comply with ADR regulations for Class 3 substances, including proper placarding, driver certification, and emergency equipment requirements.

Is pentan-2-yl acetate subject to specific regulations?

Pentan-2-yl acetate is subject to standard chemical regulations including REACH registration requirements in Europe and CLP classification as Flam. Liq. 3 with Warning signal word. It is not classified as a Substance of Very High Concern (SVHC). Users must comply with occupational health and safety regulations, proper labeling requirements, and maintain safety data sheets for workplace use.

Where to buy pentan-2-yl acetate in Europe?

Pentan-2-yl acetate is available through OYSI, a leading European distributor of specialty chemicals. OYSI provides high-quality pentan-2-yl acetate with proper documentation, safety data sheets, and regulatory compliance for industrial and professional applications. Contact OYSI directly for availability, technical specifications, packaging options, and delivery throughout Europe while ensuring full regulatory compliance.

Data Sources

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