Benzoyl cyanide

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Names

[ CAS No. ]:
613-90-1

[ Name ]:
Benzoyl cyanide

[Synonym ]:
MFCD00001837
Benzoyl nitrile
Benzoyl cyanide
Phenylglyoxylonitrile
α-Oxobenzeneacetonitrile
Benzeneacetonitrile, α-oxo-
Oxo(phenyl)acetonitrile
Glyoxylonitrile,phenyl
benzoyl cianide
Glyoxylonitrile, phenyl-
2-oxo-2-phenylethanenitrile
2-oxo-2-phenylacetonitrile
EINECS 210-359-7

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
206.0±9.0 °C at 760 mmHg

[ Melting Point ]:
28-31 °C(lit.)

[ Molecular Formula ]:
C₈H₅NO

[ Molecular Weight ]:
131.131

[ Flash Point ]:
78.4±18.7 °C

[ Exact Mass ]:
131.037109

[ PSA ]:
40.86000

[ LogP ]:
1.04

[ Vapour Pressure ]:
0.2±0.4 mmHg at 25°C

[ Index of Refraction ]:
1.546

[ Water Solubility ]:
slihtly soluble, decomposes

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS06

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H300

[ Precautionary Statements ]:
P264-P301 + P310

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges

[ Hazard Codes ]:
T:Toxic;N:Dangerousfortheenvironment;

[ Risk Phrases ]:
R20;R24/25;R34;R50

[ Safety Phrases ]:
S36/37/39-S45-S61-S29-S26

[ RIDADR ]:
UN 3439 6.1/PG 2

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1(b)

[ HS Code ]:
29269095

Precursor & DownStream

Precursor

a-Oxobenzeneacetaldehyde Aldoxime
Trimethylsilyl cyanide
Benzoyl chloride
Sodium cyanide
3-oxo-3-phenyl-propanamide
Iodobenzene
carbon monoxide
POTASSIUM CYANIDE
Phenylglyoxal
bis(2-phenylethynyl)mercury

DownStream

2-hydroxy-2-(2-methylphenyl)-1-phenylethanone
Benzil
(R)-2-HYDROXY-2-CYCLOHEXYLACETONITRILE
4-PHENYL-2H-PYRAZOL-3-YLAMINE
4-PHENYL-1H-PYRAZOL-3-AMINE
4'-nitrobenzanilide
2-Benzoylcyclohexanone
Tritanol
Triphenylmethane

Customs

[ HS Code ]: 29269095

Articles

Biosynthesis of benzoylformic acid from benzoyl cyanide by a newly isolatedRhodococcussp. CCZU10-1 in toluene–water biphasic system

Bioresour. Technol. 115 , 88-95, (2012)

Benzoylformic acid was synthesized from the hydrolysis of benzoyl cyanide by a newly isolated Rhodococcus sp. CCZU10-1. In this study, an aqueous–toluene biphasic system was developed for highly effic...

Synthesis , 433, (1993)

Quantitative evaluation of the mechanism of electroreduction of benzoyl cyanides.

J. Org. Chem. 72(2) , 589-94, (2007)

The mechanism of reduction of benzoyl cyanide, 6, p-methoxybenzoyl cyanide, 7, and p-chlorobenzoyl cyanide, 8, has been studied in acetonitrile (6 and 7), N,N-dimethylformamide (6), and acetonitrile c...