3-Chlorobenzyl cyanide , 99% , 1529-41-5

Synonym(s):
3-Chlorobenzyl cyanide

CAS NO.：1529-41-5

Empirical Formula: C8H6ClN

Molecular Weight: 151.59

MDL number: MFCD00001908

EINECS: 216-213-9

PRODUCT Properties

• Melting point: 11-13 °C(lit.)
• Boiling point: 134-136 °C10 mm Hg(lit.)
• Density: 1.283 g/mL at 25 °C(lit.)
• refractive index: n20/D 1.544(lit.)
• Flash point: >230 °F
• solubility: Chloroform (Slightly), Methanol (Slightly)
• form: clear liquid
• color: Colorless to Light yellow to Light orange
• Specific Gravity: 1.280～1.282
• BRN: 2042965
• Exposure limits: NIOSH: IDLH 25 mg/m3
• Stability: Stable. Incompatible with strong acids, strong bases, strong oxidizing agents, strong reducing agents.
• InChIKey: GTIKLPYCSAMPNG-UHFFFAOYSA-N
• CAS DataBase Reference: 1529-41-5(CAS DataBase Reference)
• NIST Chemistry Reference: Benzeneacetonitrile, 3-chloro-(1529-41-5)

Description and Uses

3-Chlorobenzyl Cyanide is a useful synthetic intermediate. It was used to design EGFR Tyrosine Kinase Inhibitors. It can also be used to synthesize imidoyl thioureas as non-nucleoside reverse transcriptase inhibitors.

Safety

• Symbol(GHS): GHS06
• Signal word: Danger
• Hazard statements: H301+H311+H331
• Precautionary statements: P261-P264-P280-P301+P310-P302+P352+P312-P304+P340+P311
• Hazard Codes: T
• Risk Statements: 23/24/25-36/37/38
• Safety Statements: 36/37/39-45-28B
• RIDADR: UN 3276 6.1/PG 1
• WGK Germany: 3
• RTECS: AL8240000
• HazardClass: 6.1
• PackingGroup: II
• HS Code: 29269090
• Toxicity: mouse,LD50,intraperitoneal,38mg/kg (38mg/kg),PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGEBEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD,Pesticide Biochemistry and Physiology. Vol. 2, Pg. 95, 1972.