ChemSpider 2D Image | Ethyl 6-amino-2-phenyl-1H-indole-3-carboxylate | C17H16N2O2

Ethyl 6-amino-2-phenyl-1H-indole-3-carboxylate

  • Molecular FormulaC17H16N2O2
  • Average mass280.321 Da
  • Monoisotopic mass280.121185 Da
  • ChemSpider ID23346484

More details:

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

1H-Indole-3-carboxylic acid, 6-amino-2-phenyl-, ethyl ester [ACD/Index Name]
6-Amino-2-phényl-1H-indole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
945655-38-9 [RN]
Ethyl 6-amino-2-phenyl-1H-indole-3-carboxylate [ACD/IUPAC Name]
Ethyl-6-amino-2-phenyl-1H-indol-3-carboxylat [German] [ACD/IUPAC Name]
(4-Isobutyrylphenyl)boronic acid [ACD/IUPAC Name]
[945655-38-9] [RN]
1H-Indole-3-carboxylicacid, 6-amino-2-phenyl-, ethyl ester
4-isobutyrylphenylboronic acid
AGN-PC-09MQPP
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 541.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 81.9±3.0 kJ/mol
    Flash Point: 281.2±30.1 °C
    Index of Refraction: 1.672
    Molar Refractivity: 83.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 3
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.02
    ACD/LogD (pH 5.5): 3.55
    ACD/BCF (pH 5.5): 289.92
    ACD/KOC (pH 5.5): 1975.53
    ACD/LogD (pH 7.4): 3.58
    ACD/BCF (pH 7.4): 310.13
    ACD/KOC (pH 7.4): 2113.22
    Polar Surface Area: 68 Å2
    Polarizability: 33.2±0.5 10-24cm3
    Surface Tension: 56.8±3.0 dyne/cm
    Molar Volume: 223.8±3.0 cm3

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