ChemSpider 2D Image | 2-({[4-(Cyclopropylsulfamoyl)phenyl]sulfonyl}amino)-5-fluorobenzoic acid | C16H15FN2O6S2

2-({[4-(Cyclopropylsulfamoyl)phenyl]sulfonyl}amino)-5-fluorobenzoic acid

  • Molecular FormulaC16H15FN2O6S2
  • Average mass414.428 Da
  • Monoisotopic mass414.035553 Da
  • ChemSpider ID26206088

More details:

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

2-({[4-(Cyclopropylsulfamoyl)phenyl]sulfonyl}amino)-5-fluorbenzoesäure [German] [ACD/IUPAC Name]
2-({[4-(Cyclopropylsulfamoyl)phenyl]sulfonyl}amino)-5-fluorobenzoic acid [ACD/IUPAC Name]
Acide 2-({[4-(cyclopropylsulfamoyl)phényl]sulfonyl}amino)-5-fluorobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-[[[4-[(cyclopropylamino)sulfonyl]phenyl]sulfonyl]amino]-5-fluoro- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 616.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.1±3.0 kJ/mol
Flash Point: 326.6±34.3 °C
Index of Refraction: 1.683
Molar Refractivity: 94.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.03
ACD/LogD (pH 5.5): 0.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.44
ACD/LogD (pH 7.4): -0.46
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 80.7±5.0 dyne/cm
Molar Volume: 249.6±5.0 cm3

Click to predict properties on the Chemicalize site


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