ChemSpider 2D Image | 4-{[1-(2-Methoxyethyl)-1H-pyrazol-3-yl]sulfamoyl}-2-thiophenecarboxylic acid | C11H13N3O5S2

4-{[1-(2-Methoxyethyl)-1H-pyrazol-3-yl]sulfamoyl}-2-thiophenecarboxylic acid

  • Molecular FormulaC11H13N3O5S2
  • Average mass331.368 Da
  • Monoisotopic mass331.029663 Da
  • ChemSpider ID67892012

More details:

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

2-Thiophenecarboxylic acid, 4-[[[1-(2-methoxyethyl)-1H-pyrazol-3-yl]amino]sulfonyl]- [ACD/Index Name]
4-{[1-(2-Methoxyethyl)-1H-pyrazol-3-yl]sulfamoyl}-2-thiophencarbonsäure [German] [ACD/IUPAC Name]
4-{[1-(2-Methoxyethyl)-1H-pyrazol-3-yl]sulfamoyl}-2-thiophenecarboxylic acid [ACD/IUPAC Name]
Acide 4-{[1-(2-méthoxyéthyl)-1H-pyrazol-3-yl]sulfamoyl}-2-thiophènecarboxylique [French] [ACD/IUPAC Name]
4-{[1-(2-METHOXYETHYL)-1H-PYRAZOL-3-YL]SULFAMOYL}THIOPHENE-2-CARBOXYLIC ACID
4-{[1-(2-METHOXYETHYL)PYRAZOL-3-YL]SULFAMOYL}THIOPHENE-2-CARBOXYLIC ACID

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

Density: 1.6±0.1 g/cm3
Boiling Point: 580.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.3±3.0 kJ/mol
Flash Point: 304.6±32.9 °C
Index of Refraction: 1.681
Molar Refractivity: 78.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.97
ACD/LogD (pH 5.5): -1.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 147 Å2
Polarizability: 31.2±0.5 10-24cm3
Surface Tension: 67.8±7.0 dyne/cm
Molar Volume: 207.9±7.0 cm3

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