ChemSpider 2D Image | N-(1-Cyanocyclopropyl)-2-[4-(trifluoromethyl)benzyl]butanamide | C16H17F3N2O

N-(1-Cyanocyclopropyl)-2-[4-(trifluoromethyl)benzyl]butanamide

  • Molecular FormulaC16H17F3N2O
  • Average mass310.314 Da
  • Monoisotopic mass310.129303 Da
  • ChemSpider ID35206540

More details:

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

Benzenepropanamide, N-(1-cyanocyclopropyl)-α-ethyl-4-(trifluoromethyl)- [ACD/Index Name]
N-(1-Cyancyclopropyl)-2-[4-(trifluormethyl)benzyl]butanamid [German] [ACD/IUPAC Name]
N-(1-Cyanocyclopropyl)-2-[4-(trifluoromethyl)benzyl]butanamide [ACD/IUPAC Name]
N-(1-Cyanocyclopropyl)-2-[4-(trifluorométhyl)benzyl]butanamide [French] [ACD/IUPAC Name]
1825349-25-4 [RN]
N-(1-CYANOCYCLOPROPYL)-2-{[4-(TRIFLUOROMETHYL)PHENYL]METHYL}BUTANAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 476.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.1±3.0 kJ/mol
Flash Point: 242.2±28.7 °C
Index of Refraction: 1.513
Molar Refractivity: 75.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.84
ACD/LogD (pH 5.5): 2.81
ACD/BCF (pH 5.5): 80.49
ACD/KOC (pH 5.5): 804.90
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 80.49
ACD/KOC (pH 7.4): 804.89
Polar Surface Area: 53 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 41.4±5.0 dyne/cm
Molar Volume: 249.9±5.0 cm3

Click to predict properties on the Chemicalize site


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