Basic information
- Name:
Benzeneacetonitrile, a-ethyl-
- Superlist Name:
- 2-Phenylbutyronitrile
- CAS No.:
769-68-6
- Molecular Structure:
- Formula:
- C10H11 N
- Molecular Weight:
- 145.20
- Synonyms:
- Butyronitrile,2-phenyl- (6CI,7CI,8CI); (?à)-2-Phenylbutyronitrile; 1-Cyano-1-phenylpropane; 2-Phenylbutanenitrile;2-Phenylbutyronitrile; Butanenitrile, 2-phenyl-; NSC 11272; NSC 2373; a-Ethylbenzeneacetonitrile; a-Phenylbutyronitrile
- EINECS:
- 212-213-8
- Density:
- 1.45
- Flash Point:
- 105 ºC
- Hazard Symbols:
- Risk Codes:
- R20/21/22
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Chemistry
Molecular structure of 2-Phenylbutyronitrile (CAS NO.769-68-6) is:
Product Name: 2-Phenylbutyronitrile
CAS Registry Number: 769-68-6
IUPAC Name: 2-Phenylbutanenitrile
Molecular Weight: 145.20104 [g/mol]
Molecular Formula: C10H11N
XLogP3-AA: 2.5
H-Bond Donor: 0
H-Bond Acceptor: 1
EINECS: 212-213-8
Refractive index: n20/D 1.5086(lit.)
Index of Refraction: 1.514
Molar Refractivity: 44.98 cm3
Molar Volume: 149.3 cm3
Surface Tension: 37.7 dyne/cm
Density: 0.971 g/cm3
Flash Point: 105 °C
Enthalpy of Vaporization: 47.39 kJ/mol
Boiling Point: 237.1 °C at 760 mmHg
Vapour Pressure: 0.0457 mmHg at 25 °C
Other Registry Number: 69350-73-8
Safety Profile
Safty information about 2-Phenylbutyronitrile (CAS NO.769-68-6) is:
Hazard Codes: 
Xn
Risk Statements: 20/21/22
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements: 36/37
S36/37:Wear suitable protective clothing and gloves.
RIDADR: 3276
WGK Germany: 3
HazardClass: 6.1
PackingGroup: III
Specification
2-Phenylbutyronitrile , its cas register number is 769-68-6. It also can be called 1-Cyano-1-phenylpropane ; Benzeneacetonitrile, alpha-ethyl- ; Butanenitrile, 2-phenyl- ; alpha-Phenylbutyronitrile ; DL-2-Phenylbutyronitrile .
