ChemSpider 2D Image | 3-[(Cyclopropylmethyl)(2,6-difluorobenzyl)amino]propanenitrile | C14H16F2N2

3-[(Cyclopropylmethyl)(2,6-difluorobenzyl)amino]propanenitrile

  • Molecular FormulaC14H16F2N2
  • Average mass250.287 Da
  • Monoisotopic mass250.128159 Da
  • ChemSpider ID35163590

More details:

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

3-[(Cyclopropylmethyl)(2,6-difluorbenzyl)amino]propannitril [German] [ACD/IUPAC Name]
3-[(Cyclopropylmethyl)(2,6-difluorobenzyl)amino]propanenitrile [ACD/IUPAC Name]
3-[(Cyclopropylméthyl)(2,6-difluorobenzyl)amino]propanenitrile [French] [ACD/IUPAC Name]
Propanenitrile, 3-[(cyclopropylmethyl)[(2,6-difluorophenyl)methyl]amino]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 354.7±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.0±3.0 kJ/mol
Flash Point: 168.3±25.1 °C
Index of Refraction: 1.533
Molar Refractivity: 65.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.65
ACD/LogD (pH 5.5): 1.85
ACD/BCF (pH 5.5): 10.61
ACD/KOC (pH 5.5): 124.41
ACD/LogD (pH 7.4): 2.47
ACD/BCF (pH 7.4): 44.13
ACD/KOC (pH 7.4): 517.39
Polar Surface Area: 27 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 44.9±3.0 dyne/cm
Molar Volume: 210.1±3.0 cm3

Click to predict properties on the Chemicalize site


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