ChemSpider 2D Image | 4-[Cyclohexyl(methyl)amino]-3,5-difluorobenzonitrile | C14H16F2N2

4-[Cyclohexyl(methyl)amino]-3,5-difluorobenzonitrile

  • Molecular FormulaC14H16F2N2
  • Average mass250.287 Da
  • Monoisotopic mass250.128159 Da
  • ChemSpider ID30102034

More details:

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

4-[Cyclohexyl(methyl)amino]-3,5-difluorbenzonitril [German] [ACD/IUPAC Name]
4-[Cyclohexyl(methyl)amino]-3,5-difluorobenzonitrile [ACD/IUPAC Name]
4-[Cyclohexyl(méthyl)amino]-3,5-difluorobenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4-(cyclohexylmethylamino)-3,5-difluoro- [ACD/Index Name]
1356757-31-7 [RN]
MFCD22742358

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

Density: 1.2±0.1 g/cm3
Boiling Point: 374.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.2±3.0 kJ/mol
Flash Point: 180.4±27.9 °C
Index of Refraction: 1.531
Molar Refractivity: 65.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.55
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 577.65
ACD/KOC (pH 5.5): 3298.39
ACD/LogD (pH 7.4): 3.94
ACD/BCF (pH 7.4): 578.10
ACD/KOC (pH 7.4): 3300.96
Polar Surface Area: 27 Å2
Polarizability: 26.1±0.5 10-24cm3
Surface Tension: 42.1±5.0 dyne/cm
Molar Volume: 212.5±5.0 cm3

Click to predict properties on the Chemicalize site


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