ChemSpider 2D Image | 3-(7-Chloro-1H-indol-3-yl)-2-iminopropanoate | C11H8ClN2O2

3-(7-Chloro-1H-indol-3-yl)-2-iminopropanoate

  • Molecular FormulaC11H8ClN2O2
  • Average mass235.647 Da
  • Monoisotopic mass235.027985 Da
  • ChemSpider ID26331741

  • Charge - Charge

More details:

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

1H-Indole-3-propanoic acid, 7-chloro-α-imino-, ion(1-) [ACD/Index Name]
3-(7-Chlor-1H-indol-3-yl)-2-iminopropanoat [German] [ACD/IUPAC Name]
3-(7-Chloro-1H-indol-3-yl)-2-iminopropanoate [ACD/IUPAC Name]
3-(7-Chloro-1H-indol-3-yl)-2-iminopropanoate [French] [ACD/IUPAC Name]
2-imino-3-(7-chloroindol-3-yl)propanoate
2-imino-3-(7-chloroindol-3-yl)propanoate anion
2-imino-3-(7-chloroindol-3-yl)propanoate(1-)
2-imino-3-(7-chloroindol-3-yl)propionate anion
2-imino-3-(7-chloroindol-3-yl)propionate(1-)
  • Miscellaneous

    • Chemical Class:

      The conjugate base of 2-iminio-3-(7-chloroindol-3-yl)propionate arising from deprotonation of the iminio function. ChEBI CHEBI:59887

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

Density:
Boiling Point: 481.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.5±3.0 kJ/mol
Flash Point: 244.7±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.51
ACD/LogD (pH 5.5): 0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.88
ACD/LogD (pH 7.4): 0.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.88
Polar Surface Area: 80 Å2
Polarizability:
Surface Tension:
Molar Volume:

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