ChemSpider 2D Image | trans-3-Methoxycyclobutanecarboxylic acid | C6H10O3

trans-3-Methoxycyclobutanecarboxylic acid

  • Molecular FormulaC6H10O3
  • Average mass130.142 Da
  • Monoisotopic mass130.062988 Da
  • ChemSpider ID29784475

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1408076-05-0 [RN]
Acide trans-3-méthoxycyclobutanecarboxylique [French] [ACD/IUPAC Name]
Cyclobutanecarboxylic acid, 3-methoxy-, trans- [ACD/Index Name]
trans-3-Methoxycyclobutancarbonsäure [German] [ACD/IUPAC Name]
trans-3-Methoxycyclobutanecarboxylic acid [ACD/IUPAC Name]
3-Methoxycyclobutanecarboxylic acid [ACD/IUPAC Name]
552849-35-1 [RN]
95%
cis-3-Methoxycyclobutanecarboxylic acid [ACD/IUPAC Name]
MFCD22396944
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 230.2±33.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 51.4±6.0 kJ/mol
    Flash Point: 96.6±18.9 °C
    Index of Refraction: 1.470
    Molar Refractivity: 31.1±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.17
    ACD/LogD (pH 5.5): -0.76
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.99
    ACD/LogD (pH 7.4): -2.56
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 47 Å2
    Polarizability: 12.3±0.5 10-24cm3
    Surface Tension: 39.3±5.0 dyne/cm
    Molar Volume: 111.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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