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 structural properties and moderate toxicity classification. This organic compound, also known by its IUPAC name 2-methylpropanoic acid, represents an important member of the short-chain carboxylic acid family. With the molecular formula C4H8O2 and a molecular weight of 88.11 g/mol, this branched carboxylic acid exhibits unique chemical characteristics that distinguish it from its linear counterparts. The compound's branched structure, featuring a methyl group attached to the alpha carbon, influences both its physical properties and reactivity patterns. From a safety perspective, 2-methylpropanoic acid carries an Acute Toxicity Category 4 classification with a Warning signal word and GHS07 pictogram, indicating moderate hazard potential requiring appropriate handling precautions. Its ADR Class 3 classification identifies it as a flammable liquid, necessitating proper storage and transport protocols in industrial applications. The compound finds significant use in the chemical industry as an intermediate for pharmaceutical synthesis, where its branched structure provides specific steric properties valuable in drug development. It also serves as a precursor in the production of specialty esters and serves in polymer chemistry applications. Unlike related compounds such as 2-butoxyethyl acetate, which primarily functions as a solvent, 2-methylpropanoic acid's carboxylic functionality makes it particularly suitable for synthesis reactions requiring controlled reactivity. Industrial applications benefit from its moderate reactivity profile and well-characterized safety parameters, making it a reliable building block for various chemical processes. OYSI provides reliable supply of 2-methylpropanoic acid to meet diverse industrial requirements across European markets.

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. This organic compound, also known as isobutyric acid, has a molecular weight of 88.11 g/mol and belongs to the family of short-chain fatty acids. It is classified as a hazardous substance with acute toxicity properties (Acute Tox. 4) and requires appropriate handling precautions during use and storage.

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 typical of carboxylic acids. It is miscible with water and most organic solvents due to its polar carboxyl group and relatively short carbon chain. The compound has a boiling point around 154°C and a melting point of approximately -47°C, making it liquid under normal storage and handling conditions.

What is 2-methylpropanoic acid used for?

2-methylpropanoic acid is primarily used as an intermediate in chemical synthesis and as a flavoring agent in the food industry. It serves as a precursor for the production of esters, salts, and other derivatives used in pharmaceuticals, perfumes, and plastic additives. The compound is also utilized in the manufacture of synthetic lubricants and as a chemical building block in various organic synthesis processes.

How to handle 2-methylpropanoic acid safely?

2-methylpropanoic acid requires careful handling due to its Acute Tox. 4 classification and GHS07 pictogram warning. Wear appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing. Ensure adequate ventilation to prevent inhalation of vapors. Avoid direct skin and eye contact, and never ingest the substance. Work in well-ventilated areas or use local exhaust ventilation to minimize exposure risks.

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 direct sunlight. Keep containers upright to prevent leakage and store away from incompatible materials such as strong bases, oxidizing agents, and metals that may react with carboxylic acids. Ensure storage areas are equipped with appropriate spill containment measures and maintain temperatures within recommended ranges.

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

2-methylpropanoic acid exposure requires immediate action due to its acute toxicity classification. For skin contact, immediately remove contaminated clothing and rinse affected area with plenty of water for at least 15 minutes. In case of eye contact, flush eyes with water for 15 minutes while holding eyelids open. If inhaled, move to fresh air immediately. For ingestion, do not induce vomiting and seek immediate medical attention.

How to dispose of 2-methylpropanoic acid appropriately?

2-methylpropanoic acid disposal must comply with local and national hazardous waste regulations due to its toxicity classification. The substance should be collected in appropriate containers and disposed of through licensed hazardous waste disposal facilities. Never discharge into drains, sewers, or the environment. Small quantities may be neutralized with appropriate bases under controlled conditions by qualified personnel before disposal, following all applicable environmental regulations.

How to transport 2-methylpropanoic acid?

2-methylpropanoic acid is classified under ADR Class 3 (flammable liquids), Packing Group III, indicating moderate danger during transport. The substance must be packaged in UN-approved containers with appropriate labeling including the flammable liquid hazard label. Transport vehicles must comply with ADR requirements including proper documentation, emergency equipment, and driver training. Ensure containers are properly secured and protected from temperature extremes during transit.

Is 2-methylpropanoic acid subject to specific regulations?

2-methylpropanoic acid is subject to various European chemical regulations including REACH registration requirements and CLP classification and labeling obligations. The substance is not currently listed as a Substance of Very High Concern (SVHC). Companies must comply with safety data sheet requirements, workplace exposure limits, and notification obligations. Users must implement appropriate risk management measures based on the substance's Acute Tox. 4 classification.

Where to buy 2-methylpropanoic acid in Europe?

2-methylpropanoic acid is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides high-quality 2-methylpropanoic acid with complete regulatory documentation including safety data sheets and certificates of analysis. As an established chemical distributor, OYSI ensures compliance with European regulations and offers reliable supply chains across European markets for industrial and professional users requiring this specialty chemical.

Data Sources

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