ChemSpider 2D Image | (2Z)-2-Cyano-3-cyclopropyl-3-hydroxy-N-(4-nitrophenyl)acrylamide | C13H11N3O4

(2Z)-2-Cyano-3-cyclopropyl-3-hydroxy-N-(4-nitrophenyl)acrylamide

  • Molecular FormulaC13H11N3O4
  • Average mass273.244 Da
  • Monoisotopic mass273.074951 Da
  • ChemSpider ID23217314

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-Cyan-3-cyclopropyl-3-hydroxy-N-(4-nitrophenyl)acrylamid [German] [ACD/IUPAC Name]
(2Z)-2-Cyano-3-cyclopropyl-3-hydroxy-N-(4-nitrophenyl)acrylamide [ACD/IUPAC Name]
(2Z)-2-Cyano-3-cyclopropyl-3-hydroxy-N-(4-nitrophényl)acrylamide [French] [ACD/IUPAC Name]
(2Z)-2-cyano-3-cyclopropyl-3-hydroxy-N-(4-nitrophenyl)prop-2-enamide
2-Propenamide, 2-cyano-3-cyclopropyl-3-hydroxy-N-(4-nitrophenyl)-, (2Z)- [ACD/Index Name]
(Z)-2-Cyano-3-cyclopropyl-3-hydroxy-N-(4-nitro-phenyl)-acrylamide
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL344556/

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 536.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.6±3.0 kJ/mol
Flash Point: 278.3±30.1 °C
Index of Refraction: 1.709
Molar Refractivity: 69.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.33
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 2.24
ACD/KOC (pH 5.5): 38.67
ACD/LogD (pH 7.4): -0.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 119 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 92.3±3.0 dyne/cm
Molar Volume: 177.3±3.0 cm3

Click to predict properties on the Chemicalize site


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