ChemSpider 2D Image | 6-Chloro-N-{[1-(2,4-difluorophenyl)-1H-pyrazol-4-yl]methyl}-2H-chromene-3-carboxamide | C20H14ClF2N3O2

6-Chloro-N-{[1-(2,4-difluorophenyl)-1H-pyrazol-4-yl]methyl}-2H-chromene-3-carboxamide

  • Molecular FormulaC20H14ClF2N3O2
  • Average mass401.794 Da
  • Monoisotopic mass401.074249 Da
  • ChemSpider ID29827601

More details:

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

2H-1-Benzopyran-3-carboxamide, 6-chloro-N-[[1-(2,4-difluorophenyl)-1H-pyrazol-4-yl]methyl]- [ACD/Index Name]
6-Chlor-N-{[1-(2,4-difluorphenyl)-1H-pyrazol-4-yl]methyl}-2H-chromen-3-carboxamid [German] [ACD/IUPAC Name]
6-Chloro-N-{[1-(2,4-difluorophenyl)-1H-pyrazol-4-yl]methyl}-2H-chromene-3-carboxamide [ACD/IUPAC Name]
6-Chloro-N-{[1-(2,4-difluorophényl)-1H-pyrazol-4-yl]méthyl}-2H-chromène-3-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 621.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.0±3.0 kJ/mol
Flash Point: 329.4±31.5 °C
Index of Refraction: 1.644
Molar Refractivity: 101.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.70
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 1057.98
ACD/KOC (pH 5.5): 5087.71
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 1057.99
ACD/KOC (pH 7.4): 5087.71
Polar Surface Area: 56 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 47.9±7.0 dyne/cm
Molar Volume: 279.5±7.0 cm3

Click to predict properties on the Chemicalize site


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