ChemSpider 2D Image | 1-Boc-6-Chloroindole | C13H14ClNO2

1-Boc-6-Chloroindole

  • Molecular FormulaC13H14ClNO2
  • Average mass251.709 Da
  • Monoisotopic mass251.071304 Da
  • ChemSpider ID21472619

More details:

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

1-Boc-6-Chloroindole
1H-Indole-1-carboxylic acid, 6-chloro-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 6-chloro-1H-indole-1-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-6-chlor-1H-indol-1-carboxylat [German] [ACD/IUPAC Name]
323580-68-3 [RN]
6-Chloro-1H-indole-1-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 6-chloro-1H-indole-1-carboxylate
[323580-68-3] [RN]
1,2-bis(4-chlorophenyl)ethane-1,2-diamine
1-Boc-6-chloro-1H-indole
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 349.9±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.4±3.0 kJ/mol
    Flash Point: 165.4±25.7 °C
    Index of Refraction: 1.557
    Molar Refractivity: 68.1±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 4.46
    ACD/LogD (pH 5.5): 4.16
    ACD/BCF (pH 5.5): 861.78
    ACD/KOC (pH 5.5): 4392.98
    ACD/LogD (pH 7.4): 4.16
    ACD/BCF (pH 7.4): 861.78
    ACD/KOC (pH 7.4): 4392.98
    Polar Surface Area: 31 Å2
    Polarizability: 27.0±0.5 10-24cm3
    Surface Tension: 38.5±7.0 dyne/cm
    Molar Volume: 211.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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