ChemSpider 2D Image | tert-Butyl 6-hydroxyindoline-1-carboxylate | C13H17NO3

tert-Butyl 6-hydroxyindoline-1-carboxylate

  • Molecular FormulaC13H17NO3
  • Average mass235.279 Da
  • Monoisotopic mass235.120850 Da
  • ChemSpider ID26330430

More details:

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

1H-Indole-1-carboxylic acid, 2,3-dihydro-6-hydroxy-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 6-hydroxy-1-indolinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-6-hydroxy-1-indolincarboxylat [German] [ACD/IUPAC Name]
6-Hydroxy-1-indolinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
957204-30-7 [RN]
tert-Butyl 6-hydroxyindoline-1-carboxylate
[957204-30-7] [RN]
1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-6-HYDROXY-,1,1-DIMETHYLETHYL ESTER
6-hydroxy-2,3-dihydroindole-1-carboxylic acid tert-butyl ester
95%
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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: 371.5±41.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.3±3.0 kJ/mol
    Flash Point: 178.5±27.6 °C
    Index of Refraction: 1.570
    Molar Refractivity: 64.1±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.83
    ACD/LogD (pH 5.5): 2.91
    ACD/BCF (pH 5.5): 95.94
    ACD/KOC (pH 5.5): 912.66
    ACD/LogD (pH 7.4): 2.91
    ACD/BCF (pH 7.4): 95.71
    ACD/KOC (pH 7.4): 910.48
    Polar Surface Area: 50 Å2
    Polarizability: 25.4±0.5 10-24cm3
    Surface Tension: 48.9±3.0 dyne/cm
    Molar Volume: 195.2±3.0 cm3

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