ChemSpider 2D Image | 2-Oxo-2-{[2-(trifluoromethyl)benzyl]amino}ethyl 3,5-difluorobenzoate | C17H12F5NO3

2-Oxo-2-{[2-(trifluoromethyl)benzyl]amino}ethyl 3,5-difluorobenzoate

  • Molecular FormulaC17H12F5NO3
  • Average mass373.274 Da
  • Monoisotopic mass373.073730 Da
  • ChemSpider ID31098105

More details:

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

2-Oxo-2-{[2-(trifluormethyl)benzyl]amino}ethyl-3,5-difluorbenzoat [German] [ACD/IUPAC Name]
2-Oxo-2-{[2-(trifluoromethyl)benzyl]amino}ethyl 3,5-difluorobenzoate [ACD/IUPAC Name]
3,5-Difluorobenzoate de 2-oxo-2-{[2-(trifluorométhyl)benzyl]amino}éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3,5-difluoro-, 2-oxo-2-[[[2-(trifluoromethyl)phenyl]methyl]amino]ethyl ester [ACD/Index Name]
({[2-(trifluoromethyl)phenyl]methyl}carbamoyl)methyl 3,5-difluorobenzoate
1794931-32-0 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 509.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.0±3.0 kJ/mol
Flash Point: 261.9±30.1 °C
Index of Refraction: 1.510
Molar Refractivity: 80.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.87
ACD/LogD (pH 5.5): 3.78
ACD/BCF (pH 5.5): 436.86
ACD/KOC (pH 5.5): 2701.21
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 436.86
ACD/KOC (pH 7.4): 2701.20
Polar Surface Area: 55 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 38.2±3.0 dyne/cm
Molar Volume: 268.9±3.0 cm3

Click to predict properties on the Chemicalize site


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