ChemSpider 2D Image | 5-[(4-Sulfamoyl-1-piperazinyl)sulfonyl]-1H-pyrazole-4-carboxylic acid | C8H13N5O6S2

5-[(4-Sulfamoyl-1-piperazinyl)sulfonyl]-1H-pyrazole-4-carboxylic acid

  • Molecular FormulaC8H13N5O6S2
  • Average mass339.349 Da
  • Monoisotopic mass339.030731 Da
  • ChemSpider ID38740009

More details:

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

1H-Pyrazole-4-carboxylic acid, 5-[[4-(aminosulfonyl)-1-piperazinyl]sulfonyl]- [ACD/Index Name]
5-[(4-Sulfamoyl-1-piperazinyl)sulfonyl]-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
5-[(4-Sulfamoyl-1-piperazinyl)sulfonyl]-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
Acide 5-[(4-sulfamoyl-1-pipérazinyl)sulfonyl]-1H-pyrazole-4-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 724.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.0±3.0 kJ/mol
Flash Point: 391.7±35.7 °C
Index of Refraction: 1.730
Molar Refractivity: 70.3±0.4 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -2.57
ACD/LogD (pH 5.5): -4.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 184 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 129.2±5.0 dyne/cm
Molar Volume: 176.1±5.0 cm3

Click to predict properties on the Chemicalize site


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