ChemSpider 2D Image | Methyl N-acetyl-6-fluoro-D-tryptophanate | C14H15FN2O3

Methyl N-acetyl-6-fluoro-D-tryptophanate

  • Molecular FormulaC14H15FN2O3
  • Average mass278.279 Da
  • Monoisotopic mass278.106659 Da
  • ChemSpider ID24605459

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Tryptophan, N-acetyl-6-fluoro-, methyl ester [ACD/Index Name]
Methyl N-acetyl-6-fluoro-D-tryptophanate [ACD/IUPAC Name]
Methyl-N-acetyl-6-fluor-D-tryptophanat [German] [ACD/IUPAC Name]
N-Acétyl-6-fluoro-D-tryptophanate de méthyle [French] [ACD/IUPAC Name]
(R)-Methyl 2-acetamido-3-(6-fluoro-1H-indol-3-yl)propanoate
(R)-N-Acetyl-6-Fluoro-Trp-OMe
(R)-N-Acetyl-6-fluoro-Trp-OMe (Ac-D-Trp(6-F)-OMe)
[1234842-62-6] [RN]
1234842-62-6 [RN]
METHYL (2R)-2-ACETAMIDO-3-(6-FLUORO-1H-INDOL-3-YL)PROPANOATE
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 514.7±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.6±3.0 kJ/mol
    Flash Point: 265.1±30.1 °C
    Index of Refraction: 1.585
    Molar Refractivity: 72.0±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.05
    ACD/LogD (pH 5.5): 1.42
    ACD/BCF (pH 5.5): 7.13
    ACD/KOC (pH 5.5): 141.94
    ACD/LogD (pH 7.4): 1.42
    ACD/BCF (pH 7.4): 7.13
    ACD/KOC (pH 7.4): 141.94
    Polar Surface Area: 71 Å2
    Polarizability: 28.5±0.5 10-24cm3
    Surface Tension: 49.2±3.0 dyne/cm
    Molar Volume: 214.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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