3-Chloropropiononitrile

3-Chloropropiononitrile Basic information
Product Name:3-Chloropropiononitrile
Synonyms:3-chloro-propanenitril;3-Chloropropanenitrile;3-chloro-Propanenitrile;3-Chloropropanenitrile-Chloroethylcyanide;3-Chloropropanonitrile;3-chloro-propionitril;3-Chloropropuinitrile;3-Chlorpropannitril
CAS:542-76-7
MF:C3H4ClN
MW:89.52
EINECS:208-827-0
Product Categories:API Intermediate;C1 to C5;Organics;Cyanides/Nitriles;Nitrogen Compounds
Mol File:542-76-7.mol
3-Chloropropiononitrile Structure
3-Chloropropiononitrile Chemical Properties
Melting point -52--50 °C (lit.)
Boiling point 174-176 °C (lit.)
density 1.144 g/mL at 25 °C (lit.)
refractive index n20/D 1.438(lit.)
Fp 168 °F
storage temp. Store below +30°C.
solubility 45g/l
form clear liquid
color Colorless to Almost colorless
Water Solubility 4.50 g/100 mL
Merck 14,2160
BRN 1098454
CAS DataBase Reference542-76-7(CAS DataBase Reference)
NIST Chemistry ReferenceCl(CH2)2CN(542-76-7)
EPA Substance Registry System3-Chloropropionitrile (542-76-7)
Safety Information
Hazard Codes T+
Risk Statements 23-28
Safety Statements 36/37/39-45
RIDADR UN 3276 6.1/PG 2
WGK Germany 3
RTECS UG1400000
TSCA Yes
HazardClass 6.1
PackingGroup II
HS Code 29269095
Hazardous Substances Data542-76-7(Hazardous Substances Data)
ToxicityLD50 orally in mice, rats: 9, 100 mg/kg, Fassett in Industrial Hygiene and Toxicology vol. 2, F. A. Patty, Ed. (Interscience, New York, 2nd ed., 1962) pp 2025-2026
MSDS Information
ProviderLanguage
3-Chloropropiononitrile English
SigmaAldrich English
ALFA English
3-Chloropropiononitrile Usage And Synthesis
Chemical Properties3-Chloropropionitrile is a combustible, colorless liquid with an acrid odor
UsesIn pharmaceutical and polymer synthesis. Combines the reactivity of a nitrile and an alkyl halide. Because of the cyano group the chlorine atom is more reactive than in ordinary alkyl halides.
Uses3-Chloropropionitrile is used in pharmaceutical and polymer synthesis.
General DescriptionColorless liquid with a characteristic acrid odor. Used in pharmaceutical and polymer synthesis.
Reactivity ProfileToxic gas (hydrogen chloride) is released when the compound is heated above 266 F. When heated to decomposition, 3-Chloropropiononitrile emits very toxic fumes of chlorine- containing compounds and nitrogen oxides. Avoid heat. [EPA, 1998].
HazardToxic by ingestion, inhalation, and skin contact. Combustible.
Health HazardToxic effects are a result of systemic cyanide poisoning. (Non-Specific -- Cyanide) Few poisons are more rapidly lethal. Average oral lethal dose for hydrogen cyanide is approximately 60-90 mg (corresponds to 200 mg of potassium cyanide). Cause of death is lack of oxygen to the body's cells (especially the brain and heart) as a result of the chemical inhibiting cell enzymes.
Fire HazardToxic gas (hydrogen chloride) is released when the compound is heated above 266F. When heated to decomposition, 3-Chloropropiononitrile emits very toxic fumes of chlorine- containing compounds and nitrogen oxides. Avoid heat.
Potential ExposureThis material is used in pharmaceutical manufacture and in polymer synthesis.
ShippingUN3276 Nitriles, liquid, toxic, n.o.s., Hazard Class: 6.1; Labels: 6.1-Poisonous materials, Technical Name Required, Potential Inhalation Hazard (Special Provision 5).
IncompatibilitiesContact with strong oxidizers may cause a fire and explosion hazard
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