ChemSpider 2D Image | 3,4-Dimethoxy-1H-pyrrole-2,5-dicarboxylic acid | C8H9NO6

3,4-Dimethoxy-1H-pyrrole-2,5-dicarboxylic acid

  • Molecular FormulaC8H9NO6
  • Average mass215.160 Da
  • Monoisotopic mass215.042984 Da
  • ChemSpider ID21413170

More details:

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

1H-Pyrrole-2,5-dicarboxylic acid, 3,4-dimethoxy- [ACD/Index Name]
3,4-Dimethoxy-1H-pyrrol-2,5-dicarbonsäure [German] [ACD/IUPAC Name]
3,4-Dimethoxy-1H-pyrrole-2,5-dicarboxylic acid [ACD/IUPAC Name]
Acide 3,4-diméthoxy-1H-pyrrole-2,5-dicarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 489.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.6±3.0 kJ/mol
Flash Point: 249.9±28.7 °C
Index of Refraction: 1.596
Molar Refractivity: 47.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.56
ACD/LogD (pH 5.5): -2.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.72
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 68.1±3.0 dyne/cm
Molar Volume: 140.8±3.0 cm3

Click to predict properties on the Chemicalize site


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