ChemSpider 2D Image | cis-1-Amino-3-fluorocyclobutanecarboxylic acid | C5H8FNO2

cis-1-Amino-3-fluorocyclobutanecarboxylic acid

  • Molecular FormulaC5H8FNO2
  • Average mass133.121 Da
  • Monoisotopic mass133.053909 Da
  • ChemSpider ID28489492

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1s,3s)-1-amino-3-fluorocyclobutane-1-carboxylic acid
222727-43-7 [RN]
Acide cis-1-amino-3-fluorocyclobutanecarboxylique [French] [ACD/IUPAC Name]
cis-1-Amino-3-fluorcyclobutancarbonsäure [German] [ACD/IUPAC Name]
cis-1-Amino-3-fluorocyclobutanecarboxylic acid [ACD/IUPAC Name]
Cyclobutanecarboxylic acid, 1-amino-3-fluoro-, cis- [ACD/Index Name]
(1s,3s)-1-amino-3-fluorocyclobutanecarboxylic acid
1033700-92-3 [RN]
915796-08-6 [RN]
Chemistry 11927
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 254.0±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 54.1±6.0 kJ/mol
    Flash Point: 107.4±27.3 °C
    Index of Refraction: 1.497
    Molar Refractivity: 28.5±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 3
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.61
    ACD/LogD (pH 5.5): -3.12
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.14
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 63 Å2
    Polarizability: 11.3±0.5 10-24cm3
    Surface Tension: 47.4±5.0 dyne/cm
    Molar Volume: 97.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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