ChemSpider 2D Image | 4-[1-(4-Sulfamoylphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl](carboxy-~11~C)benzoic acid | C1611CH12F3N3O4S

4-[1-(4-Sulfamoylphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl](carboxy-11C)benzoic acid

  • Molecular FormulaC1611CH12F3N3O4S
  • Average mass410.356 Da
  • Monoisotopic mass410.061493 Da
  • ChemSpider ID26631205
  • Non-standard isotope - Non-standard isotope

More details:

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

4-[1-(4-Sulfamoylphenyl)-3-(trifluormethyl)-1H-pyrazol-5-yl](carboxy-11C)benzoesäure [German] [ACD/IUPAC Name]
4-[1-(4-Sulfamoylphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl](carboxy-11C)benzoic acid [ACD/IUPAC Name]
Acide 4-[1-(4-sulfamoylphényl)-3-(trifluorométhyl)-1H-pyrazol-5-yl](carboxy-11C)benzoïque [French] [ACD/IUPAC Name]
Benzoic-carboxy-11C acid, 4-[1-[4-(aminosulfonyl)phenyl]-3-(trifluoromethyl)-1H-pyrazol-5-yl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.635
Molar Refractivity: 93.8±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 55.7±7.0 dyne/cm
Molar Volume: 261.8±7.0 cm3

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