ChemSpider 2D Image | (trans-4-Aminocyclohexyl)acetic acid | C8H15NO2

(trans-4-Aminocyclohexyl)acetic acid

  • Molecular FormulaC8H15NO2
  • Average mass157.210 Da
  • Monoisotopic mass157.110275 Da
  • ChemSpider ID23255186

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(trans-4-Aminocyclohexyl)acetic acid [ACD/IUPAC Name]
(trans-4-Aminocyclohexyl)essigsäure [German] [ACD/IUPAC Name]
2952-00-3 [RN]
Acide (trans-4-aminocyclohexyl)acétique [French] [ACD/IUPAC Name]
Cyclohexaneacetic acid, 4-amino-, trans- [ACD/Index Name]
trans-2-(4-Aminocyclohexyl)acetic acid
(4-Amino-cyclohexyl)-acetic acid
1197-54-2 [RN]
2-(4-Aminocyclohexyl)acetic acid
2-(trans-4-Aminocyclohexyl)acetic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 301.3±15.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 59.6±6.0 kJ/mol
    Flash Point: 136.0±20.4 °C
    Index of Refraction: 1.488
    Molar Refractivity: 42.1±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.31
    ACD/LogD (pH 5.5): -2.25
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.20
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 63 Å2
    Polarizability: 16.7±0.5 10-24cm3
    Surface Tension: 43.7±3.0 dyne/cm
    Molar Volume: 146.2±3.0 cm3

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