ChemSpider 2D Image | Methyl 6-chloro-1H-indole-3-carboxylate | C10H8ClNO2

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

  • Molecular FormulaC10H8ClNO2
  • Average mass209.629 Da
  • Monoisotopic mass209.024353 Da
  • ChemSpider ID26486376

More details:

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

1H-Indole-3-carboxylic acid, 6-chloro-, methyl ester [ACD/Index Name]
6-Chloro-1H-indole-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
921194-97-0 [RN]
Methyl 6-chloro-1H-indole-3-carboxylate [ACD/IUPAC Name]
Methyl-6-chlor-1H-indol-3-carboxylat [German] [ACD/IUPAC Name]
[921194-97-0] [RN]
1H-INDOLE-3-CARBOXYLIC ACID,6-CHLORO-,METHYL ESTER
6-Chloro-1H-indol-3-carboxylic acid methyl ester
6-Chloro-1H-indole-3-Carbocylic acid methyl ester
6-Chloro-1H-indole-3-carboxylic acid methyl ester
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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: 1.4±0.1 g/cm3
    Boiling Point: 365.5±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.2±3.0 kJ/mol
    Flash Point: 174.8±22.3 °C
    Index of Refraction: 1.648
    Molar Refractivity: 55.2±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.13
    ACD/LogD (pH 5.5): 3.13
    ACD/BCF (pH 5.5): 140.63
    ACD/KOC (pH 5.5): 1200.07
    ACD/LogD (pH 7.4): 3.13
    ACD/BCF (pH 7.4): 140.63
    ACD/KOC (pH 7.4): 1200.07
    Polar Surface Area: 42 Å2
    Polarizability: 21.9±0.5 10-24cm3
    Surface Tension: 54.1±3.0 dyne/cm
    Molar Volume: 151.7±3.0 cm3

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