2-methylpropanoic acid

C4H8O2

CAS79-31-2
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
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Identification

CAS Number
79-31-2
EC Number
201-195-7
UN Number
2529
Index Number
607-063-00-9
PubChem CID
6590

Physical-chemical properties

Molecular Formula
C4H8O2
Molar Mass
88.11 g/mol
IUPAC Name
2-methylpropanoic acid

Chemical Identifiers

InChI
InChI=1S/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6)
InChI Key
KQNPFQTWMSNSAP-UHFFFAOYSA-N

Overview

2-methylpropanoic acid (CAS 79-31-2) is a branched-chain carboxylic acid with distinctive chemical properties and industrial applications. This organic compound, also known by its IUPAC name 2-methylpropanoic acid, belongs to the family of short-chain carboxylic acids characterized by a branched molecular structure. With the molecular formula C4H8O2 and a molecular weight of 88.11 g/mol, this chemical substance exhibits typical carboxylic acid behavior while offering unique properties due to its methyl branching at the alpha position. The compound presents as a colorless liquid with a characteristic pungent odor typical of carboxylic acids. Its branched structure influences its physical and chemical properties, differentiating it from linear carboxylic acids of similar molecular weight. The presence of the carboxyl functional group makes it acidic and capable of forming salts with bases, while the branched alkyl chain affects its solubility and reactivity patterns. From a safety perspective, 2-methylpropanoic acid is classified under GHS as Acute Toxicity Category 4, requiring appropriate handling precautions. The substance carries a Warning signal word and displays the GHS07 pictogram, indicating potential health hazards upon exposure. Its ADR Class 3 classification identifies it as a flammable liquid, necessitating proper storage and transportation protocols. Industrial applications include its use as a chemical intermediate in pharmaceutical synthesis, as a component in specialty chemical formulations, and in the production of esters for various industrial processes. Unlike related compounds such as 2-butoxyethyl acetate which serves primarily as a solvent, 2-methylpropanoic acid functions predominantly as a building block in organic synthesis. OYSI provides this technical-grade chemical to European industrial customers requiring reliable supply chains for their manufacturing processes.

Safety & Classification

Warning
Classification:

Acute Tox. 4 *; Acute Tox. 4 *

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H312

Harmful in contact with skin.

H302

Harmful if swallowed.

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

Skin Contact

Harmful

Measures if substance contacts the skin

First Aid Actions

  • +P302IF ON SKIN:
  • +P352Wash with plenty of water.
  • +P361Take off immediately all contaminated clothing.
  • +P313Get medical advice/attention.

Related hazard statements:

Ingestion

Harmful

Measures if substance is accidentally swallowed

First Aid Actions

  • +P301IF SWALLOWED:
  • +P330Rinse mouth.
  • +P331Do NOT induce vomiting.
  • +P310Immediately call 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 Number2529
ADR Class3
Packing GroupIII
Tunnel CodeD/E
Proper Shipping NameIsobuttersäure
Marine PollutantNo

Frequently Asked Questions

What is 2-methylpropanoic acid?

2-methylpropanoic acid is a branched-chain carboxylic acid with the molecular formula C4H8O2 and CAS number 79-31-2. Also known as isobutyric acid, it features a methyl group attached to the second carbon of a propanoic acid backbone. With a molecular weight of 88.11 g/mol, this organic compound is classified as moderately toxic (Acute Tox. 4) and requires careful handling in industrial applications.

What are the physicochemical properties of 2-methylpropanoic acid?

2-methylpropanoic acid is a colorless liquid at room temperature with a characteristic pungent, rancid odor reminiscent of butter or cheese. It is highly soluble in water and most organic solvents due to its carboxylic acid functionality. The compound has a boiling point of approximately 154°C and a melting point of -47°C. Its density is around 0.95 g/cm³, making it slightly less dense than water.

What is 2-methylpropanoic acid used for?

2-methylpropanoic acid serves primarily as an intermediate in chemical synthesis and pharmaceutical manufacturing. It is used in the production of esters for flavoring agents, particularly in food and fragrance industries where it provides buttery or fruity notes. The compound also finds applications in the synthesis of various organic compounds, including pharmaceuticals, plasticizers, and specialty chemicals for industrial processes.

How to handle 2-methylpropanoic acid safely?

Safe handling of 2-methylpropanoic acid requires appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing. Work in well-ventilated areas or under fume hoods to avoid inhalation exposure. The substance carries GHS07 pictogram and Warning signal word due to its Acute Tox. 4 classification. Avoid skin and eye contact, and prevent vapor accumulation in confined spaces during handling operations.

How to store 2-methylpropanoic acid correctly?

2-methylpropanoic acid should be stored in tightly sealed containers in a cool, dry, well-ventilated area away from heat sources and ignition points. Keep containers upright and protected from direct sunlight. Store separately from strong oxidizing agents, bases, and reactive metals to prevent dangerous reactions. Ensure storage areas have appropriate spill containment measures and maintain temperatures below 25°C when possible for optimal stability.

What to do in case of contact with 2-methylpropanoic acid?

In case of skin contact with 2-methylpropanoic acid, immediately remove contaminated clothing and rinse affected area with plenty of water for at least 15 minutes. For eye contact, flush thoroughly with water for 15 minutes while holding eyelids open. If inhaled, move to fresh air immediately. If swallowed, do not induce vomiting and rinse mouth with water. Seek medical attention if irritation persists or symptoms develop.

How to dispose of 2-methylpropanoic acid appropriately?

2-methylpropanoic acid disposal must comply with local and national environmental regulations. The substance should be treated as hazardous waste and disposed of through licensed waste management facilities. Small quantities may be neutralized carefully with appropriate bases under controlled conditions by qualified personnel. Never dispose of this chemical down drains or in regular waste streams. Contact certified waste disposal companies for proper collection and treatment.

How to transport 2-methylpropanoic acid?

2-methylpropanoic acid is classified as ADR Class 3 (flammable liquids), Packing Group III for transportation purposes. It requires appropriate packaging according to UN regulations and proper labeling with hazard diamonds. Vehicles must carry appropriate emergency equipment and documentation. Drivers need ADR certification for transporting this substance. Ensure containers are properly sealed and secured during transport to prevent spills or leakage.

Is 2-methylpropanoic acid subject to specific regulations?

2-methylpropanoic acid is subject to European REACH regulation requiring registration for commercial use. It falls under CLP classification as Acute Tox. 4 with mandatory safety data sheet provision. The substance is not currently listed as SVHC (Substance of Very High Concern). Industrial users must comply with occupational exposure limits and workplace safety regulations. Import/export may require additional documentation depending on quantities and destinations.

Where to buy 2-methylpropanoic acid in Europe?

2-methylpropanoic acid is available through OYSI, a trusted European distributor of specialty chemicals. OYSI supplies high-quality 2-methylpropanoic acid to industrial customers across Europe with proper documentation and regulatory compliance. As an established chemical distributor, OYSI ensures product quality, appropriate packaging, and reliable delivery while maintaining full regulatory compliance including REACH requirements and safety documentation for professional applications.

Data Sources

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