ChemSpider 2D Image | 3-Amino-5,7,7-trimethyloctanoic acid | C11H23NO2

3-Amino-5,7,7-trimethyloctanoic acid

  • Molecular FormulaC11H23NO2
  • Average mass201.306 Da
  • Monoisotopic mass201.172882 Da
  • ChemSpider ID21800586

More details:

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

3-Amino-5,7,7-trimethyloctanoic acid [ACD/IUPAC Name]
3-Amino-5,7,7-trimethyl-octanoic acid
3-Amino-5,7,7-trimethyloctansäure [German] [ACD/IUPAC Name]
773122-45-5 [RN]
Acide 3-amino-5,7,7-triméthyloctanoïque [French] [ACD/IUPAC Name]
Octanoic acid, 3-amino-5,7,7-trimethyl- [ACD/Index Name]
[773122-45-5] [RN]
169750-76-9 [RN]
3-Amino-5,7,7-trimethyloctanoicacid
3-AMINO-5,7,7-TRIMETHYL-OCTANOICACID
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD06205962 [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: 304.1±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 59.9±6.0 kJ/mol
    Flash Point: 137.7±23.2 °C
    Index of Refraction: 1.466
    Molar Refractivity: 58.0±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 3
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.66
    ACD/LogD (pH 5.5): 0.03
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.77
    ACD/LogD (pH 7.4): 0.03
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.79
    Polar Surface Area: 63 Å2
    Polarizability: 23.0±0.5 10-24cm3
    Surface Tension: 35.4±3.0 dyne/cm
    Molar Volume: 209.2±3.0 cm3

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