ChemSpider 2D Image | Ethyl 1-oxo-2,3,4,9-tetrahydro-1H-beta-carboline-6-carboxylate | C14H14N2O3

Ethyl 1-oxo-2,3,4,9-tetrahydro-1H-β-carboline-6-carboxylate

  • Molecular FormulaC14H14N2O3
  • Average mass258.273 Da
  • Monoisotopic mass258.100433 Da
  • ChemSpider ID24808394

More details:

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

1967-75-5 [RN]
1H-Pyrido[3,4-b]indole-6-carboxylic acid, 2,3,4,9-tetrahydro-1-oxo-, ethyl ester [ACD/Index Name]
1-OXO-2,3,4,9-TETRAHYDRO-1H-B-CARBOLINE-6-CARBOXYLIC ACID ETHYL ESTER
1-Oxo-2,3,4,9-tétrahydro-1H-β-carboline-6-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 1-oxo-2,3,4,9-tetrahydro-1H-β-carboline-6-carboxylate [ACD/IUPAC Name]
Ethyl-1-oxo-2,3,4,9-tetrahydro-1H-β-carbolin-6-carboxylat [German] [ACD/IUPAC Name]
[1967-75-5] [RN]
1-OXO-2,3,4,9-TETRAHYDRO-1H-SS-CARBOLINE-6-CARBOXYLIC ACID ETHYL ESTER
1-Oxo-2,3,4,9-tetrahydro-1H-β-carboline-6-carboxylic acid ethyl ester
ethyl 1-oxo-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-6-carboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 565.7±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 85.0±3.0 kJ/mol
    Flash Point: 295.9±30.1 °C
    Index of Refraction: 1.641
    Molar Refractivity: 70.6±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.71
    ACD/LogD (pH 5.5): 2.36
    ACD/BCF (pH 5.5): 36.46
    ACD/KOC (pH 5.5): 456.66
    ACD/LogD (pH 7.4): 2.36
    ACD/BCF (pH 7.4): 36.46
    ACD/KOC (pH 7.4): 456.66
    Polar Surface Area: 71 Å2
    Polarizability: 28.0±0.5 10-24cm3
    Surface Tension: 56.4±3.0 dyne/cm
    Molar Volume: 195.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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