ChemSpider 2D Image | (2Z)-N-(3-Chloro-2'-methoxy-4-biphenylyl)-2-cyano-3-hydroxy-2-butenamide | C18H15ClN2O3

(2Z)-N-(3-Chloro-2'-methoxy-4-biphenylyl)-2-cyano-3-hydroxy-2-butenamide

  • Molecular FormulaC18H15ClN2O3
  • Average mass342.776 Da
  • Monoisotopic mass342.077118 Da
  • ChemSpider ID24700256

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-N-(3-Chlor-2'-methoxy-4-biphenylyl)-2-cyan-3-hydroxy-2-butenamid [German] [ACD/IUPAC Name]
(2Z)-N-(3-Chloro-2'-methoxy-4-biphenylyl)-2-cyano-3-hydroxy-2-butenamide [ACD/IUPAC Name]
(2Z)-N-(3-Chloro-2'-méthoxy-4-biphénylyl)-2-cyano-3-hydroxy-2-buténamide [French] [ACD/IUPAC Name]
(2Z)-N-(3-chloro-2'-methoxybiphenyl-4-yl)-2-cyano-3-hydroxybut-2-enamide
2-Butenamide, N-(3-chloro-2'-methoxy[1,1'-biphenyl]-4-yl)-2-cyano-3-hydroxy-, (2Z)- [ACD/Index Name]
(2Z)-N-[2-chloro-4-(2-methoxyphenyl)phenyl]-2-cyano-3-hydroxybut-2-enamide
cyanohydroxybutenamide, 19
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL483161/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 525.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.2±3.0 kJ/mol
Flash Point: 271.5±30.1 °C
Index of Refraction: 1.632
Molar Refractivity: 91.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 2.77
ACD/BCF (pH 5.5): 51.55
ACD/KOC (pH 5.5): 377.48
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.57
Polar Surface Area: 82 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 55.0±3.0 dyne/cm
Molar Volume: 257.4±3.0 cm3

Click to predict properties on the Chemicalize site


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