ChemSpider 2D Image | 5-Methoxy-1-methyl-3-[(E)-2-nitrovinyl]-1H-indole | C12H12N2O3

5-Methoxy-1-methyl-3-[(E)-2-nitrovinyl]-1H-indole

  • Molecular FormulaC12H12N2O3
  • Average mass232.235 Da
  • Monoisotopic mass232.084793 Da
  • ChemSpider ID28823870

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Indole, 5-methoxy-1-methyl-3-[(E)-2-nitroethenyl]- [ACD/Index Name]
5-Methoxy-1-methyl-3-[(E)-2-nitrovinyl]-1H-indol [German] [ACD/IUPAC Name]
5-Methoxy-1-methyl-3-[(E)-2-nitrovinyl]-1H-indole [ACD/IUPAC Name]
5-Méthoxy-1-méthyl-3-[(E)-2-nitrovinyl]-1H-indole [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 421.5±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 64.9±3.0 kJ/mol
Flash Point: 208.7±24.6 °C
Index of Refraction: 1.583
Molar Refractivity: 63.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.38
ACD/LogD (pH 5.5): 2.53
ACD/BCF (pH 5.5): 49.10
ACD/KOC (pH 5.5): 565.09
ACD/LogD (pH 7.4): 2.53
ACD/BCF (pH 7.4): 49.10
ACD/KOC (pH 7.4): 565.09
Polar Surface Area: 60 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 45.2±7.0 dyne/cm
Molar Volume: 189.7±7.0 cm3

Click to predict properties on the Chemicalize site


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