ChemSpider 2D Image | 1-Ethyl-4-[(4-iodo-2-methylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid | C14H15IN2O4S

1-Ethyl-4-[(4-iodo-2-methylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid

  • Molecular FormulaC14H15IN2O4S
  • Average mass434.249 Da
  • Monoisotopic mass433.979706 Da
  • ChemSpider ID63016156

More details:

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

1-Ethyl-4-[(4-iod-2-methylphenyl)sulfamoyl]-1H-pyrrol-2-carbonsäure [German] [ACD/IUPAC Name]
1-Ethyl-4-[(4-iodo-2-methylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid [ACD/IUPAC Name]
1H-Pyrrole-2-carboxylic acid, 1-ethyl-4-[[(4-iodo-2-methylphenyl)amino]sulfonyl]- [ACD/Index Name]
Acide 1-éthyl-4-[(4-iodo-2-méthylphényl)sulfamoyl]-1H-pyrrole-2-carboxylique [French] [ACD/IUPAC Name]
1-ETHYL-4-[(4-IODO-2-METHYLPHENYL)SULFAMOYL]PYRROLE-2-CARBOXYLIC ACID

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

Density: 1.8±0.1 g/cm3
Boiling Point: 571.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.1±3.0 kJ/mol
Flash Point: 299.3±32.9 °C
Index of Refraction: 1.673
Molar Refractivity: 92.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.70
ACD/LogD (pH 5.5): 1.39
ACD/BCF (pH 5.5): 2.31
ACD/KOC (pH 5.5): 17.81
ACD/LogD (pH 7.4): 0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.25
Polar Surface Area: 97 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 57.0±7.0 dyne/cm
Molar Volume: 247.2±7.0 cm3

Click to predict properties on the Chemicalize site


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