ChemSpider 2D Image | N-(2-Amino-3-fluoro-4-{[4-(trifluoromethyl)benzyl]amino}phenyl)-3,3-dimethylbutanamide | C20H23F4N3O

N-(2-Amino-3-fluoro-4-{[4-(trifluoromethyl)benzyl]amino}phenyl)-3,3-dimethylbutanamide

  • Molecular FormulaC20H23F4N3O
  • Average mass397.410 Da
  • Monoisotopic mass397.177734 Da
  • ChemSpider ID129267188

More details:

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

Butanamide, N-[2-amino-3-fluoro-4-[[[4-(trifluoromethyl)phenyl]methyl]amino]phenyl]-3,3-dimethyl- [ACD/Index Name]
N-(2-Amino-3-fluor-4-{[4-(trifluormethyl)benzyl]amino}phenyl)-3,3-dimethylbutanamid [German] [ACD/IUPAC Name]
N-(2-Amino-3-fluoro-4-{[4-(trifluoromethyl)benzyl]amino}phenyl)-3,3-dimethylbutanamide [ACD/IUPAC Name]
N-(2-Amino-3-fluoro-4-{[4-(trifluorométhyl)benzyl]amino}phényl)-3,3-diméthylbutanamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 506.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.6±3.0 kJ/mol
Flash Point: 260.2±30.1 °C
Index of Refraction: 1.577
Molar Refractivity: 102.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.60
ACD/LogD (pH 5.5): 3.86
ACD/BCF (pH 5.5): 500.09
ACD/KOC (pH 5.5): 2917.97
ACD/LogD (pH 7.4): 3.89
ACD/BCF (pH 7.4): 535.26
ACD/KOC (pH 7.4): 3123.20
Polar Surface Area: 67 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 42.1±3.0 dyne/cm
Molar Volume: 308.8±3.0 cm3

Click to predict properties on the Chemicalize site


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