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3-Oxo-3-phenylpropanenitrile

Names

[ CAS No. ]:
614-16-4

[ Name ]:
3-Oxo-3-phenylpropanenitrile

[Synonym ]:
EINECS 210-369-1
α-Cyanoacetophenone
MFCD00001942
2-cyano-1-phenylethanone
Cyanoacetophenone
3-phenyl-3-oxopropionitrile
Benzenepropanenitrile, β-oxo-
3-oxo-3-phenylpropionitrile
3-Oxo-3-phenylpropanenitrile
PHENACYL CYANIDE
Acetonitrile, benzoyl-
Benzoylacetonitrile
i-cyanoacetophenone
3-Oxo-3-phenyl-propionitrile
2-CYANOACETOPHENONE

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
301.5±0.0 °C at 760 mmHg

[ Melting Point ]:
82-83 °C(lit.)

[ Molecular Formula ]:
C9H7NO

[ Molecular Weight ]:
145.158

[ Flash Point ]:
132.9±22.6 °C

[ Exact Mass ]:
145.052765

[ PSA ]:
40.86000

[ LogP ]:
0.97

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.536

[ Water Solubility ]:
slightly soluble

MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302 + H312 + H332-H315-H319-H335

[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xn:Harmful

[ Risk Phrases ]:
R20/21/22;R36/37/38

[ Safety Phrases ]:
S26-S36-S36/37/39-S22

[ RIDADR ]:
3276

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ HS Code ]:
2926909090

Synthetic Route

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%

Articles

Design, synthesis, and anti-melanogenic effects of (E)-2-benzoyl-3-(substituted phenyl)acrylonitriles.

Drug Des. Devel. Ther. 9 , 4259-68, (2015)

Tyrosinase is the most prominent target for inhibitors of hyperpigmentation because it plays a critical role in melaninogenesis. Although many tyrosinase inhibitors have been identified, from both nat...

Pyrazolo[3,4-d]pyrimidines as adenosine antagonists.

Heterocycles 22 , 1, (1984)

A large number of nitrogen heterocycles structurally related to caffeine and theophylline have been tested for activity as adenosine antagonists. Preliminary screening, utilizing displacement of [3H]N...

J. Heterocycl. Chem. 15 , 57, (1978)


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Related Compounds

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