SoleChem

2,2-dimethylbutyryl chloride

CAS
5856-77-9
EC
227-478-5
Mol. Weight
134.60 g/mol

Description

2,2-Dimethylbutyryl chloride (CAS 5856-77-9) is a reactive acyl chloride used as a building block in organic synthesis and pharmaceutical manufacturing. It introduces the 2,2-dimethylbutanoyl group into target molecules through acylation reactions.

This chemical enables the construction of complex intermediates with defined steric profiles. In pharmaceutical synthesis, it acylates amines, alcohols, and other nucleophiles to produce protected intermediates and active pharmaceutical ingredient precursors.

The compound is particularly useful where steric bulk at the alpha-carbon is required. Fragrance and flavor chemists use it to prepare ester and amide derivatives with specific branched-chain profiles suited to fine fragrance and aroma formulations.

Biotechnology and life sciences researchers employ it in the preparation of prodrugs, enzyme substrates, and biochemical probes. These applications often require controlled lipophilicity and hydrolytic stability as primary design criteria.

It also functions as a catalyst precursor component in select organometallic and coordination chemistry applications. The material is supplied as a liquid, typically in reagent or synthesis grade for industrial and laboratory use.

It is available in small research quantities through to multi-kilogram lots for process-scale applications. Purity specifications commonly range from 95% to 98%+ depending on the intended synthetic use and specific customer requirements.

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Physical Properties

Melting Point -20 °C
Boiling Point 130.3-131.3 °C
Density 0.9787 g/cm³ @ Temp: 20 °C
Flash Point 29°C
Color Clear Colorless
Form Oil
Water Solubility Reacts with water. Soluble in chloroform and ethyl acetate.
Refractive Index 1.4240

Safety & Handling (Learn More)

Danger GHS02 GHS05
Hazard Statements
H226 Flammable liquid and vapor
H290 May be corrosive to metals
H314 Causes severe skin burns and eye damage
H318 Causes serious eye damage
Precautionary Statements
P210 Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.
P233 Keep container tightly closed.
P234 Keep only in original packaging.
P240 Ground and bond container and receiving equipment.
P241 Use explosion-proof [electrical/ventilating/lighting/…] equipment.
P242 Use non-sparking tools.
P243 Take action to prevent static discharges.
P260 Do not breathe dust/fume/gas/mist/vapours/spray.
P264 Wash … thoroughly after handling.
P280 Wear protective gloves/protective clothing/eye protection/face protection.
P316 Get emergency medical help immediately.
P317 Get emergency medical help.
P321 Specific treatment (see … on this label).
P363 Wash contaminated clothing before reuse.
P390 Absorb spillage to prevent material damage.
P405 Store locked up.
P406 Store in a corrosion-resistant/… container with a resistant inner liner.
P501 Dispose of contents/container in accordance with local regulations.
P264+P265 Wash … thoroughly after handling.
P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.
P370+P378 Use … for extinction.
P403+P235 Store in a well-ventilated place. Keep cool.
P301+P330+P331 Rinse mouth. Do NOT induce vomiting.
P302+P361+P354 IF ON SKIN: Take off immediately all contaminated clothing. Rinse skin with water/shower.
P303+P361+P353 IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water/shower.
P305+P354+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

Trade & Regulatory

HS Code 29159000
Storage Class 11 - Combustible Solids
WGK (Germany) 3

Documentation

Other Names

2,2-Dimethylbutanoyl chloride|RefChem:441400|Butanoyl chloride, 2,2-dimethyl-|Butyryl chloride, 2,2-dimethyl-|2,2-Dimethylbutyric acid chloride|Dimethylbutyryl Chloride

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