ChemSpider 2D Image | Ethyl 6-chloro-1H-indole-3-carboxylate | C11H10ClNO2

Ethyl 6-chloro-1H-indole-3-carboxylate

  • Molecular FormulaC11H10ClNO2
  • Average mass223.656 Da
  • Monoisotopic mass223.040009 Da
  • ChemSpider ID24590166

More details:






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

100821-50-9 [RN]
1H-Indole-3-carboxylic acid, 6-chloro-, ethyl ester [ACD/Index Name]
6-Chloro-1H-indole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 6-chloro-1H-indole-3-carboxylate [ACD/IUPAC Name]
Ethyl-6-chlor-1H-indol-3-carboxylat [German] [ACD/IUPAC Name]
142165-63-7 [RN]
1H-INDOLE-3-CARBOXYLIC ACID, 6-CHLORO-,ETHYL ESTER
1H-INDOLE-3-CARBOXYLIC ACID,6-CHLORO-,ETHYL ESTER
1H-INDOLE-3-CARBOXYLICACID,6-CHLORO-,ETHYLESTER
2,4-Dinitrophenylethylalcohol
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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: 375.0±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.2±3.0 kJ/mol
    Flash Point: 180.6±22.3 °C
    Index of Refraction: 1.630
    Molar Refractivity: 59.8±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.67
    ACD/LogD (pH 5.5): 3.54
    ACD/BCF (pH 5.5): 288.38
    ACD/KOC (pH 5.5): 2006.56
    ACD/LogD (pH 7.4): 3.54
    ACD/BCF (pH 7.4): 288.38
    ACD/KOC (pH 7.4): 2006.56
    Polar Surface Area: 42 Å2
    Polarizability: 23.7±0.5 10-24cm3
    Surface Tension: 51.8±3.0 dyne/cm
    Molar Volume: 168.2±3.0 cm3

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