ChemSpider 2D Image | 3-(1-Benzofuran-3-yl)-D-alanine | C11H11NO3

3-(1-Benzofuran-3-yl)-D-alanine

  • Molecular FormulaC11H11NO3
  • Average mass205.210 Da
  • Monoisotopic mass205.073898 Da
  • ChemSpider ID24828510

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3-(1-Benzofuran-3-yl)-D-alanin [German] [ACD/IUPAC Name]
3-(1-Benzofuran-3-yl)-D-alanine [ACD/IUPAC Name]
3-(1-Benzofuran-3-yl)-D-alanine [French] [ACD/IUPAC Name]
3-Benzofuranpropanoic acid, α-amino-, (αR)- [ACD/Index Name]
(R)-2-Amino-3-(benzofuran-3-yl)propanoic acid
793717-08-5 [RN]
D-3-(3-Benzoburanyl)-alanine
D-3-(3-benzofuranyl)-Alanine
MFCD09842014

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 373.1±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.4±3.0 kJ/mol
    Flash Point: 179.4±25.1 °C
    Index of Refraction: 1.640
    Molar Refractivity: 55.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.57
    ACD/LogD (pH 5.5): -1.16
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.17
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 22.1±0.5 10-24cm3
    Surface Tension: 60.1±3.0 dyne/cm
    Molar Volume: 154.3±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement