ChemSpider 2D Image | 2-Methylcyclohexanecarbonitrile | C8H13N

2-Methylcyclohexanecarbonitrile

  • Molecular FormulaC8H13N
  • Average mass123.196 Da
  • Monoisotopic mass123.104797 Da
  • ChemSpider ID25910427

More details:

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

2-Methylcyclohexancarbonitril [German] [ACD/IUPAC Name]
2-Methylcyclohexanecarbonitrile [ACD/IUPAC Name]
2-Méthylcyclohexanecarbonitrile [French] [ACD/IUPAC Name]
Cyclohexanecarbonitrile, 2-methyl- [ACD/Index Name]
2-methylcyclohexane-1-carbonitrile
90154-71-5 [RN]
MFCD11641475 [MDL number]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 208.8±9.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.5±3.0 kJ/mol
Flash Point: 73.9±6.5 °C
Index of Refraction: 1.451
Molar Refractivity: 36.9±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.10
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 42.71
ACD/KOC (pH 5.5): 511.36
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 42.71
ACD/KOC (pH 7.4): 511.36
Polar Surface Area: 24 Å2
Polarizability: 14.6±0.5 10-24cm3
Surface Tension: 31.9±5.0 dyne/cm
Molar Volume: 137.2±5.0 cm3

Click to predict properties on the Chemicalize site


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