2160. β-Chloropropionitrile

Nomenclature

CAS number: 542-76-7
3-Chloropropanenitrile; 3-chloropropanonitrile.
C3H4ClN; mol wt 89.52.
C 40.25%, H 4.50%, Cl 39.60%, N 15.65%.

Description and references

Prepd from acrylonitrile and hydrogen chloride or bromide: Moureu, Clarke, Bull. Soc. Chim. Fr. [4] 27, 905 (1920); Stewart, Clarke, J. Am. Chem. Soc. 69, 714 (1947); Shirley, Preparation of Organic Intermediates (Wiley, New York, 1951) p 82.

Chemical structure

Properties

Liquid. Acrid, characteristic odor. Poisonous. mp -51°. d425 1.1363. bp760 176° (dec); bp200 132° (dec); bp50 95.2°; bp5 46.0°. Flash pt 168°F (75.5°C). nD25 1.4341. Begins to dec when heated above 130° evolving HCl. Absorbs strongly in the infrared. Transparent to uv above 220 nm. Soly in water at 25°: 4.5 g/100 ml. Soly of water in β-chloropropionitrile at 25°: 2.2 ml/100 g. Miscible with ethanol, ether, acetone, benzene, carbon tetrachloride. LD50 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.

Caution

Exposure by any route should be avoided. Somewhat less hazardous than acrylonitrile because of lower vapor pressure. Readily penetrates skin to produce systemic cyanide poisoning, death.

Use

In 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.