3-Chlorobenzylcyanide

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Names

[ CAS No. ]:
1529-41-5

[ Name ]:
3-Chlorobenzylcyanide

[Synonym ]:
3-chlorophenylacetonitrile
Benzeneacetonitrile, 3-chloro-
(3-Chlorophenyl)acetonitrile
EINECS 216-213-9
2-(3-chlorophenyl)acetonitrile
3-Chlorobenzylcyanide
MFCD00001908

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
270.0±0.0 °C at 760 mmHg

[ Melting Point ]:
11-13 °C(lit.)

[ Molecular Formula ]:
C8H6ClN

[ Molecular Weight ]:
151.593

[ Flash Point ]:
107.7±15.4 °C

[ Exact Mass ]:
151.018875

[ PSA ]:
23.79000

[ LogP ]:
2.04

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.549

[ Stability ]:
Stable. Incompatible with strong acids, strong bases, strong oxidizing agents, strong reducing agents.

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AL8240000
CHEMICAL NAME :
Acetonitrile, (m-chlorophenyl)-
CAS REGISTRY NUMBER :
1529-41-5
BEILSTEIN REFERENCE NO. :
2042965
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C8-H6-Cl-N
MOLECULAR WEIGHT :
151.60
WISWESSER LINE NOTATION :
NC1R CG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
38 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - spastic paralysis with or without sensory change Behavioral - convulsions or effect on seizure threshold
REFERENCE :
PCBPBS Pesticide Biochemistry and Physiology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1971- Volume(issue)/page/year: 2,95,1972
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03833

Safety Information

[ Symbol ]:

GHS06

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H301-H311-H331

[ Precautionary Statements ]:
P261-P280-P301 + P310-P311

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
T:Toxic

[ Risk Phrases ]:
R23/24/25;R36/37/38

[ Safety Phrases ]:
S36/37/39-S45-S28B

[ RIDADR ]:
UN 3276 6.1/PG 1

[ WGK Germany ]:
3

[ RTECS ]:
AL8240000

[ Packaging Group ]:
II

[ Hazard Class ]:
6.1

[ HS Code ]:
2926909090

Precursor & DownStream

Precursor

  • Sodium cyanide
  • 3-chlorobenzylbromide
  • m-Chlorbenzyl chloride
  • 4-Methyl-3-nitro-N-[2-(4-pyridinyl)ethyl]-2-pyridinamine
  • N,N,N-Triethylethanaminium cyanide
  • (3-chlorophenyl)methyl 4-methoxybenzenesulfonate
  • 3-(3-chloro-phenyl)-2-thioxo-propionic acid
  • 3-Chlorotoluene
  • POTASSIUM CYANIDE

DownStream

  • 6-Chloro-1,2,3,4-tetrahydroisoquinoline
  • 1-(3-chlorophenyl)cyclopentane-1-carbonitrile
  • sodium,(6R,7R)-3-(acetyloxymethyl)-7-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
  • 1-(3-Chlorophenyl)cyclobutanecarbonitrile
  • 3-Chlorophenylacetic acid
  • 2-(3-Chlorophenyl)acetamide
  • 4-(3-CHLOROPHENYL)-1H-PYRAZOL-3-AMINE
  • (3-Chlorophenyl)(pyridin-2-yl)methanone
  • (3-chlorophenyl)(2-pyridyl)acetonitrile
  • ETHYL 3-CHLOROPHENYLACETATE

Customs

[ HS Code ]: 2926909090

[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • 3-benzyl-4-methyl-1,3-thiazol-3-ium,iodide
  • 3-CHLORO-4-(ISOPROPYLSULFONYL)THIOPHENE-2-CARBOXYLIC ACID
  • 3-(1-Benzyl-1H-indol-3-yl)-propionic acid
  • 3,3-diphenyl-4-(2-phenylethenyl)-1-tert-butyl-azetidin-2-one
  • [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone
  • 3-hydroxy-2,2,4-trimethyl-1-(2-methylphenyl)pentan-1-one