ChemSpider 2D Image | (2E)-2-Cyano-3-[3-(1H-pyrazol-4-yl)phenyl]acrylamide | C13H10N4O

(2E)-2-Cyano-3-[3-(1H-pyrazol-4-yl)phenyl]acrylamide

  • Molecular FormulaC13H10N4O
  • Average mass238.245 Da
  • Monoisotopic mass238.085464 Da
  • ChemSpider ID35034315
  • Double-bond stereo - Double-bond stereo


More details:






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

(2E)-2-Cyan-3-[3-(1H-pyrazol-4-yl)phenyl]acrylamid [German] [ACD/IUPAC Name]
(2E)-2-Cyano-3-[3-(1H-pyrazol-4-yl)phenyl]acrylamide [ACD/IUPAC Name]
(2E)-2-Cyano-3-[3-(1H-pyrazol-4-yl)phényl]acrylamide [French] [ACD/IUPAC Name]
(2e)-2-Cyano-3-[3-(1h-Pyrazol-4-Yl)phenyl]prop-2-Enamide
2-Propenamide, 2-cyano-3-[3-(1H-pyrazol-4-yl)phenyl]-, (2E)- [ACD/Index Name]
3-(3-(1H-Pyrazol-4-yl)phenyl)-2-cyanoacrylamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 629.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.1±3.0 kJ/mol
Flash Point: 334.5±31.5 °C
Index of Refraction: 1.681
Molar Refractivity: 67.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.06
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 6.43
ACD/KOC (pH 5.5): 131.88
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 6.44
ACD/KOC (pH 7.4): 131.96
Polar Surface Area: 96 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 70.9±3.0 dyne/cm
Molar Volume: 177.7±3.0 cm3

Click to predict properties on the Chemicalize site






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