ChemSpider 2D Image | 1-benzyl-5-methylindole-3-carbaldehyde | C17H15NO

1-benzyl-5-methylindole-3-carbaldehyde

  • Molecular FormulaC17H15NO
  • Average mass249.307 Da
  • Monoisotopic mass249.115356 Da
  • ChemSpider ID21800800

More details:

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

1134334-45-4 [RN]
1-Benzyl-5-methyl-1H-indol-3-carbaldehyd [German] [ACD/IUPAC Name]
1-Benzyl-5-methyl-1H-indole-3-carbaldehyde [ACD/IUPAC Name]
1-Benzyl-5-méthyl-1H-indole-3-carbaldéhyde [French] [ACD/IUPAC Name]
1-benzyl-5-methylindole-3-carbaldehyde
1H-Indole-3-carboxaldehyde, 5-methyl-1-(phenylmethyl)- [ACD/Index Name]
5-Methyl-1-(phenylmethyl)-1H-indole-3-carboxaldehyde
5-methyl-1-benzylindole-3-carbaldehyde

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

MFCD12027458 [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 454.4±33.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.4±3.0 kJ/mol
    Flash Point: 228.6±25.4 °C
    Index of Refraction: 1.599
    Molar Refractivity: 77.9±0.5 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.13
    ACD/LogD (pH 5.5): 4.84
    ACD/BCF (pH 5.5): 2830.42
    ACD/KOC (pH 5.5): 10290.34
    ACD/LogD (pH 7.4): 4.84
    ACD/BCF (pH 7.4): 2830.42
    ACD/KOC (pH 7.4): 10290.34
    Polar Surface Area: 22 Å2
    Polarizability: 30.9±0.5 10-24cm3
    Surface Tension: 41.5±7.0 dyne/cm
    Molar Volume: 227.9±7.0 cm3

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