Bromobenzyl cyanide

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Names

[ Name ]:
Bromobenzyl cyanide

[Synonym ]:
a-Bromo-a-tolunitrile
Bromobenzylnitrile
a-Bromobenzyl Cyanide
B.B.C.
a-Bromobenzeneacetonitrile
Acetonitrile,bromophenyl
a-Bromophenylacetonitrile
CA (Tear gas)
Benzeneacetonitrile, α-bromo- (9CI)
Benzeneacetonitrile, α-bromo-
Camite
Bromobenzyl cyanide
Brombenzyl cyanide
benzyl cyanide
α-Bromobenzyl cyanide
α-Bromophenylacetonitrile
Bromo(phenyl)acetonitrile
bromo-phenyl-acetonitrile

Chemical & Physical Properties

[ Density]:
1.5±0.1 g/cm3

[ Boiling Point ]:
228.0±20.0 °C at 760 mmHg

[ Melting Point ]:
29ºC

[ Molecular Formula ]:
C₈H₆BrN

[ Molecular Weight ]:
196.044

[ Flash Point ]:
91.7±21.8 °C

[ Exact Mass ]:
194.968353

[ PSA ]:
23.79000

[ LogP ]:
2.34

[ Vapour Pressure ]:
0.1±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.585

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: AL8050000

CHEMICAL NAME :: Acetonitrile, bromophenyl-

CAS REGISTRY NUMBER :: 5798-79-8

BEILSTEIN REFERENCE NO. :: 1862309

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C8-H6-Br-N

MOLECULAR WEIGHT :: 196.06

WISWESSER LINE NOTATION :: NCYER

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 100 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. (Washington, DC) Volume(issue)/page/year: 5,32,1953

TYPE OF TEST :: LC - Lethal concentration

ROUTE OF EXPOSURE :: Inhalation

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >1160 mg/m3/10M

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NDRC** National Defense Research Committee, Office of Scientific Research and Development, Progress Report. Volume(issue)/page/year: NDCrc-132,Aug,1942

Safety Information

[ RIDADR ]:
UN 1694

[ Packaging Group ]:
I

[ Hazard Class ]:
6.1(a)

[ HS Code ]:
2926909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Phosphonium,(cyanophenylmethyl)triphenyl-, bromide (1:1)
2,2-Diphenylacetonitrile
Benzoyl cyanide
Diphenylmaleic anhydride
alpha-(4-Methoxyphenyl)phenylacetic acid
2,2-diphenylethanethioamide
2-Butenedinitrile,2,3-diphenyl-, (2E)-
2-(4-methylphenyl)-2-phenyl-acetonitrile
1-Naphthaleneacetonitrile,a-phenyl-

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%