ChemSpider 2D Image | 3,5-Dimethyl-4-sulfamoyl-1H-pyrrole-2-carboxylic acid | C7H10N2O4S

3,5-Dimethyl-4-sulfamoyl-1H-pyrrole-2-carboxylic acid

  • Molecular FormulaC7H10N2O4S
  • Average mass218.230 Da
  • Monoisotopic mass218.036133 Da
  • ChemSpider ID28543126

More details:

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

1394041-61-2 [RN]
1H-Pyrrole-2-carboxylic acid, 4-(aminosulfonyl)-3,5-dimethyl- [ACD/Index Name]
3,5-Dimethyl-4-sulfamoyl-1H-pyrrol-2-carbonsäure [German] [ACD/IUPAC Name]
3,5-Dimethyl-4-sulfamoyl-1H-pyrrole-2-carboxylic acid [ACD/IUPAC Name]
Acide 3,5-diméthyl-4-sulfamoyl-1H-pyrrole-2-carboxylique [French] [ACD/IUPAC Name]
MFCD22378677

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

Density: 1.5±0.1 g/cm3
Boiling Point: 533.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.1±3.0 kJ/mol
Flash Point: 276.2±32.9 °C
Index of Refraction: 1.602
Molar Refractivity: 48.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.27
ACD/LogD (pH 5.5): -0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.51
ACD/LogD (pH 7.4): -2.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 122 Å2
Polarizability: 19.3±0.5 10-24cm3
Surface Tension: 70.9±3.0 dyne/cm
Molar Volume: 141.8±3.0 cm3

Click to predict properties on the Chemicalize site


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