ChemSpider 2D Image | (1R,3R)-3-Aminocyclohexanol | C6H13NO

(1R,3R)-3-Aminocyclohexanol

  • Molecular FormulaC6H13NO
  • Average mass115.174 Da
  • Monoisotopic mass115.099716 Da
  • ChemSpider ID29366792

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,3R)-3-aminocyclohexan-1-ol
(1R,3R)-3-Aminocyclohexanol [German] [ACD/IUPAC Name]
(1R,3R)-3-Aminocyclohexanol [ACD/IUPAC Name]
(1R,3R)-3-Aminocyclohexanol [French] [ACD/IUPAC Name]
721884-82-8 [RN]
Cyclohexanol, 3-amino-, (1R,3R)- [ACD/Index Name]
(1R,3R)-3-AMINO-CYCLOHEXANOL
40525-77-7 [RN]
MFCD03790924
MFCD18791267
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 201.1±33.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 50.9±6.0 kJ/mol
    Flash Point: 75.4±25.4 °C
    Index of Refraction: 1.503
    Molar Refractivity: 32.8±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 3
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -0.35
    ACD/LogD (pH 5.5): -3.51
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.12
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 46 Å2
    Polarizability: 13.0±0.5 10-24cm3
    Surface Tension: 38.7±3.0 dyne/cm
    Molar Volume: 111.0±3.0 cm3

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