ChemSpider 2D Image | (2E)-2-(4-Biphenylylcarbonyl)-3-(dimethylamino)acrylonitrile | C18H16N2O

(2E)-2-(4-Biphenylylcarbonyl)-3-(dimethylamino)acrylonitrile

  • Molecular FormulaC18H16N2O
  • Average mass276.332 Da
  • Monoisotopic mass276.126251 Da
  • ChemSpider ID21472455

  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2E)-2-(4-Biphenylylcarbonyl)-3-(dimethylamino)acrylonitril [German] [ACD/IUPAC Name]
(2E)-2-(4-Biphenylylcarbonyl)-3-(dimethylamino)acrylonitrile [ACD/IUPAC Name]
(2E)-2-(4-Biphénylylcarbonyl)-3-(diméthylamino)acrylonitrile [French] [ACD/IUPAC Name]
[1,1'-Biphenyl]-4-propanenitrile, α-[(dimethylamino)methylene]-β-oxo-, (αE)- [ACD/Index Name]
(E)-2-([1,1'-biphenyl]-4-carbonyl)-3-(dimethylamino)acrylonitrile
[138716-53-7] [RN]
138716-53-7 [RN]
2-([1,1'-Biphenyl]-4-carbonyl)-3-(dimethylamino)acrylonitrile
2-[(Dimethylamino)Methylene]-3-(4-Biphenylyl)-3-Oxo-Propanenitrile
2-[(Dimethylamino)methylene]-3-(biphenyl-4-yl)-3-oxopropanenitrile
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 509.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.0±3.0 kJ/mol
Flash Point: 262.0±30.1 °C
Index of Refraction: 1.588
Molar Refractivity: 82.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 210.99
ACD/KOC (pH 5.5): 1604.40
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 211.01
ACD/KOC (pH 7.4): 1604.50
Polar Surface Area: 44 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 246.3±3.0 cm3

Click to predict properties on the Chemicalize site


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