2-methylpropanoyl chloride

C4H7ClO

CAS79-30-1
GHS02 Gefahrensymbol: Entzündbar – Flamme
GHS05 Gefahrensymbol: Ätzend – Ätzwirkung
Danger

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Identification

CAS Number
79-30-1
EC Number
201-194-1
UN Number
2395
Index Number
607-140-00-7
PubChem CID
62325

Physical-chemical properties

Molecular Formula
C4H7ClO
Molar Mass
106.55 g/mol
IUPAC Name
2-methylpropanoyl chloride

Chemical Identifiers

InChI
InChI=1S/C4H7ClO/c1-3(2)4(5)6/h3H,1-2H3
InChI Key
DGMOBVGABMBZSB-UHFFFAOYSA-N

Overview

2-methylpropanoyl chloride (CAS 79-30-1) is an acyl chloride compound with high reactivity and flammable properties used in organic synthesis applications. This specialized organic compound, also known by its IUPAC name 2-methylpropanoyl chloride, represents a crucial intermediate in chemical manufacturing processes. With the molecular formula C4H7ClO and a molecular weight of 106.55 g/mol, this acyl chloride exhibits the characteristic high reactivity associated with compounds containing the -COCl functional group. The branched structure, featuring a methyl group attached to the alpha carbon, distinguishes it from linear acyl chlorides and influences both its reactivity profile and synthetic utility. The compound presents significant safety considerations due to its dual hazard classification. As a Category 2 flammable liquid, it requires careful handling around ignition sources, while its Category 1A skin corrosion classification demands robust personal protective equipment and engineering controls. The presence of both GHS02 and GHS05 pictograms on safety documentation reflects these fire and corrosion hazards, necessitating specialized storage and handling procedures in industrial environments. In synthetic chemistry, 2-methylpropanoyl chloride serves primarily as an acylating agent for introducing the 2-methylpropanoyl group into target molecules. Its applications span pharmaceutical intermediate synthesis, specialty chemical manufacturing, and research-scale organic transformations. The compound's reactivity profile makes it particularly valuable in processes requiring selective acylation under controlled conditions, similar to how other reactive intermediates like prop-2-enenitrile function in specialized synthetic pathways. OYSI maintains reliable supply chains for this essential chemical intermediate, supporting European customers with technical-grade material suitable for industrial applications.

Safety & Classification

Danger
Classification:

Flam. Liq. 2; Skin Corr. 1A

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H225

Highly flammable liquid and vapour.

H314

Causes severe skin burns and eye damage.

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:

Eye Contact

Harmful

Measures if substance gets into the eyes

First Aid Actions

  • +P305IF IN EYES:
  • +P351Rinse cautiously with water for several minutes.
  • +P338Remove contact lenses, if present and easy to do. Continue rinsing.
  • +P313Get medical advice/attention.

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 Number2395
ADR Class3
Packing GroupII
Tunnel CodeD/E
Proper Shipping NameIsobutyrylchlorid
Marine PollutantNo

Frequently Asked Questions

What is 2-methylpropanoyl chloride?

2-methylpropanoyl chloride is an organic chemical compound with the molecular formula C4H7ClO and CAS number 79-30-1. It belongs to the family of acyl chlorides, characterized by the presence of a carbonyl group bonded to a chlorine atom. This branched-chain acid chloride has a molecular weight of 106.55 g/mol and is classified as both a flammable liquid and highly corrosive substance, requiring careful handling in industrial applications.

What are the physicochemical properties of 2-methylpropanoyl chloride?

2-methylpropanoyl chloride is a colorless to pale yellow liquid with a pungent, acrid odor typical of acid chlorides. It has high reactivity with water and alcohols, leading to hydrolysis and formation of corresponding acids. The compound is highly volatile and flammable, classified as Flammable Liquid Category 2. It readily dissolves in organic solvents but reacts violently with water, making it moisture-sensitive and requiring anhydrous storage conditions.

What is 2-methylpropanoyl chloride used for?

2-methylpropanoyl chloride is primarily used as an acylating agent in organic synthesis for the production of esters, amides, and other derivatives. It serves as a key intermediate in pharmaceutical manufacturing, particularly in the synthesis of active pharmaceutical ingredients. The compound is also utilized in the production of specialty chemicals, agrochemicals, and as a reagent in laboratory research for introducing isobutyryl groups into organic molecules.

How to handle 2-methylpropanoyl chloride safely?

2-methylpropanoyl chloride requires strict safety measures due to its corrosive and flammable nature. Essential PPE includes chemical-resistant gloves, safety goggles, face shields, and acid-resistant clothing. Work must be conducted in well-ventilated areas or under fume hoods to prevent inhalation of vapors. Avoid contact with water, alcohols, and bases. Keep away from ignition sources and heat. Emergency eyewash stations and safety showers should be readily accessible.

How to store 2-methylpropanoyl chloride correctly?

2-methylpropanoyl chloride must be stored in tightly sealed, corrosion-resistant containers in a cool, dry, well-ventilated area away from heat sources and ignition. Storage temperature should be kept below 25°C to prevent decomposition. The compound is incompatible with water, alcohols, amines, and strong bases. Storage areas should be equipped with appropriate fire suppression systems and spill containment measures. Regular inspection of containers for corrosion is essential.

What to do in case of contact with 2-methylpropanoyl chloride?

2-methylpropanoyl chloride contact requires immediate emergency response due to its highly corrosive nature. For skin contact, immediately remove contaminated clothing and flush affected areas with large amounts of water for at least 15 minutes. For eye contact, rinse immediately with water for at least 15 minutes while keeping eyelids open. If inhaled, move to fresh air immediately. Seek immediate medical attention in all cases. Do not induce vomiting if swallowed.

How to dispose of 2-methylpropanoyl chloride appropriately?

2-methylpropanoyl chloride disposal must comply with local and European waste regulations as hazardous chemical waste. The compound should never be poured down drains or disposed of with regular waste. Small quantities can be carefully hydrolyzed with ice water under controlled conditions to form less hazardous isobutyric acid. Large quantities require disposal through licensed hazardous waste contractors. All containers must be properly labeled and documented according to waste tracking requirements.

How to transport 2-methylpropanoyl chloride?

2-methylpropanoyl chloride is classified under ADR as Class 3 (Flammable Liquids), Packing Group II, indicating moderate danger level for transport. It requires appropriate UN-specification packaging and proper hazard labeling with flammable liquid and corrosive symbols. Transport vehicles must comply with ADR regulations including appropriate fire extinguishing equipment. Drivers require ADR training certification. Temperature control during transport may be necessary to prevent decomposition and pressure buildup.

Is 2-methylpropanoyl chloride subject to specific regulations?

2-methylpropanoyl chloride is subject to European REACH regulation requiring registration for manufacture or import above certain tonnages. Under CLP regulation, it must be classified and labeled as Flammable Liquid Category 2 and Skin Corrosive Category 1A with appropriate hazard statements and precautionary measures. It is not currently listed as a Substance of Very High Concern (SVHC). Users must comply with occupational exposure limits and workplace safety regulations in their respective countries.

Where to buy 2-methylpropanoyl chloride in Europe?

2-methylpropanoyl chloride is available through OYSI, a specialized European distributor of technical chemicals serving industrial and research customers across Europe. OYSI provides high-quality chemical products with proper documentation, safety data sheets, and regulatory compliance support. For procurement, customers should contact OYSI directly to discuss specific requirements, quantities, and delivery options. Professional handling and storage guidance is provided with all chemical supplies to ensure safe usage.

Data Sources

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