ChemSpider 2D Image | (trans-4-Aminocyclohexyl)acetonitrile | C8H14N2

(trans-4-Aminocyclohexyl)acetonitrile

  • Molecular FormulaC8H14N2
  • Average mass138.210 Da
  • Monoisotopic mass138.115692 Da
  • ChemSpider ID38772136

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(trans-4-Aminocyclohexyl)acetonitril [German] [ACD/IUPAC Name]
(trans-4-Aminocyclohexyl)acetonitrile [ACD/IUPAC Name]
(trans-4-Aminocyclohexyl)acétonitrile [French] [ACD/IUPAC Name]
Cyclohexaneacetonitrile, 4-amino-, trans- [ACD/Index Name]
1266328-42-0 [RN]
2-(trans-4-Aminocyclohexyl)acetonitrile
2-[(1r,4r)-4-aminocyclohexyl]acetonitrile
2-[trans-4-aminocyclohexyl]acetonitrile
MFCD27942777
trans (4-Amino-cyclohexyl)-acetonitrile

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 264.8±13.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 50.3±3.0 kJ/mol
    Flash Point: 113.9±19.8 °C
    Index of Refraction: 1.470
    Molar Refractivity: 40.5±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.15
    ACD/LogD (pH 5.5): -2.56
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.23
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 50 Å2
    Polarizability: 16.0±0.5 10-24cm3
    Surface Tension: 39.1±3.0 dyne/cm
    Molar Volume: 145.0±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement