ChemSpider 2D Image | 5-Sulfino-2H-imidazole-4-carboxylic acid | C4H4N2O4S

5-Sulfino-2H-imidazole-4-carboxylic acid

  • Molecular FormulaC4H4N2O4S
  • Average mass176.151 Da
  • Monoisotopic mass175.989182 Da
  • ChemSpider ID109662341

More details:

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

2H-Imidazole-4-carboxylic acid, 5-sulfino- [ACD/Index Name]
5-Sulfino-2H-imidazol-4-carbonsäure [German] [ACD/IUPAC Name]
5-Sulfino-2H-imidazole-4-carboxylic acid [ACD/IUPAC Name]
Acide 5-sulfino-2H-imidazole-4-carboxylique [French] [ACD/IUPAC Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 521.2±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 86.9±6.0 kJ/mol
Flash Point: 269.0±25.4 °C
Index of Refraction: 1.874
Molar Refractivity: 35.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -2.75
ACD/LogD (pH 5.5): -5.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 119 Å2
Polarizability: 14.2±0.5 10-24cm3
Surface Tension: 151.4±7.0 dyne/cm
Molar Volume: 78.7±7.0 cm3

Click to predict properties on the Chemicalize site


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