ChemSpider 2D Image | 4-Chlorotryptophan | C11H11ClN2O2

4-Chlorotryptophan

  • Molecular FormulaC11H11ClN2O2
  • Average mass238.670 Da
  • Monoisotopic mass238.050903 Da
  • ChemSpider ID35302949

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

27542-41-2 [RN]
4-Chloro-D-tryptophan
4-Chlorotryptophan [ACD/IUPAC Name]
4-Chlorotryptophane [French] [ACD/IUPAC Name]
4-Chlortryptophan [German] [ACD/IUPAC Name]
Tryptophan, 4-chloro- [ACD/Index Name]
(2R)-2-amino-3-(4-chloro-1H-indol-3-yl)propanoic acid
D-TRYPTOPHAN, 4-CHLORO-
MFCD10565751

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 476.9±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.0±3.0 kJ/mol
    Flash Point: 242.2±28.7 °C
    Index of Refraction: 1.702
    Molar Refractivity: 62.7±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 4
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.63
    ACD/LogD (pH 5.5): -0.55
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.56
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 79 Å2
    Polarizability: 24.8±0.5 10-24cm3
    Surface Tension: 71.9±3.0 dyne/cm
    Molar Volume: 161.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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