ChemSpider 2D Image | 1-(tert-butoxycarbonyl)-6-methoxyindole | C14H17NO3

1-(tert-butoxycarbonyl)-6-methoxyindole

  • Molecular FormulaC14H17NO3
  • Average mass247.290 Da
  • Monoisotopic mass247.120850 Da
  • ChemSpider ID21500977

More details:

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

1-(tert-butoxycarbonyl)-6-methoxyindole
138344-18-0 [RN]
1H-Indole-1-carboxylic acid, 6-methoxy-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 6-methoxy-1H-indole-1-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-6-methoxy-1H-indol-1-carboxylat [German] [ACD/IUPAC Name]
6-Méthoxy-1H-indole-1-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 6-methoxy-1H-indole-1-carboxylate
[138344-18-0] [RN]
1-BOC-6-Methoxyindole
6-methoxy-indole-1-carboxylic acid tert-butyl ester
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 357.3±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.3±3.0 kJ/mol
    Flash Point: 169.9±25.7 °C
    Index of Refraction: 1.532
    Molar Refractivity: 69.3±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.78
    ACD/LogD (pH 5.5): 3.84
    ACD/BCF (pH 5.5): 484.98
    ACD/KOC (pH 5.5): 2911.00
    ACD/LogD (pH 7.4): 3.84
    ACD/BCF (pH 7.4): 484.98
    ACD/KOC (pH 7.4): 2911.00
    Polar Surface Area: 40 Å2
    Polarizability: 27.5±0.5 10-24cm3
    Surface Tension: 35.9±7.0 dyne/cm
    Molar Volume: 223.9±7.0 cm3

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