ChemSpider 2D Image | 2-Chloro-N-[(1s)-1-Formylpropyl]-3-(Trifluoromethyl)benzamide | C12H11ClF3NO2

2-Chloro-N-[(1s)-1-Formylpropyl]-3-(Trifluoromethyl)benzamide

  • Molecular FormulaC12H11ClF3NO2
  • Average mass293.669 Da
  • Monoisotopic mass293.043030 Da
  • ChemSpider ID25058388

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-Chlor-N-[(2S)-1-oxo-2-butanyl]-3-(trifluormethyl)benzamid [German] [ACD/IUPAC Name]
2-Chloro-N-[(1s)-1-Formylpropyl]-3-(Trifluoromethyl)benzamide
2-Chloro-N-[(2S)-1-oxo-2-butanyl]-3-(trifluoromethyl)benzamide [ACD/IUPAC Name]
2-Chloro-N-[(2S)-1-oxo-2-butanyl]-3-(trifluorométhyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 2-chloro-N-[(1S)-1-formylpropyl]-3-(trifluoromethyl)- [ACD/Index 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: 347.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.1±3.0 kJ/mol
Flash Point: 163.8±27.9 °C
Index of Refraction: 1.485
Molar Refractivity: 63.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 59.45
ACD/KOC (pH 5.5): 647.94
ACD/LogD (pH 7.4): 2.64
ACD/BCF (pH 7.4): 59.45
ACD/KOC (pH 7.4): 647.93
Polar Surface Area: 46 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 34.5±3.0 dyne/cm
Molar Volume: 222.5±3.0 cm3

Click to predict properties on the Chemicalize site


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