ChemSpider 2D Image | N-Ethyl-4'-fluoro-N-[(1R,2R)-2-hydroxycyclohexyl]-2'-methyl-4-biphenylcarboxamide | C22H26FNO2

N-Ethyl-4'-fluoro-N-[(1R,2R)-2-hydroxycyclohexyl]-2'-methyl-4-biphenylcarboxamide

  • Molecular FormulaC22H26FNO2
  • Average mass355.446 Da
  • Monoisotopic mass355.194763 Da
  • ChemSpider ID57624688

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[1,1'-Biphenyl]-4-carboxamide, N-ethyl-4'-fluoro-N-[(1R,2R)-2-hydroxycyclohexyl]-2'-methyl- [ACD/Index Name]
N-Ethyl-4'-fluor-N-[(1R,2R)-2-hydroxycyclohexyl]-2'-methyl-4-biphenylcarboxamid [German] [ACD/IUPAC Name]
N-Ethyl-4'-fluoro-N-[(1R,2R)-2-hydroxycyclohexyl]-2'-methyl-4-biphenylcarboxamide [ACD/IUPAC Name]
N-Éthyl-4'-fluoro-N-[(1R,2R)-2-hydroxycyclohexyl]-2'-méthyl-4-biphénylcarboxamide [French] [ACD/IUPAC Name]
N-ethyl-4'-fluoro-N-[(1R*,2R*)-2-hydroxycyclohexyl]-2'-methylbiphenyl-4-carboxamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 518.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 267.3±30.1 °C
Index of Refraction: 1.590
Molar Refractivity: 101.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.50
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 792.03
ACD/KOC (pH 5.5): 4135.42
ACD/LogD (pH 7.4): 4.12
ACD/BCF (pH 7.4): 792.03
ACD/KOC (pH 7.4): 4135.42
Polar Surface Area: 41 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 49.5±5.0 dyne/cm
Molar Volume: 300.4±5.0 cm3

Click to predict properties on the Chemicalize site


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