ChemSpider 2D Image | N-[5-(Cyclopropylsulfamoyl)-2-hydroxyphenyl]-2-methyl-3-nitrobenzenesulfonamide | C16H17N3O7S2

N-[5-(Cyclopropylsulfamoyl)-2-hydroxyphenyl]-2-methyl-3-nitrobenzenesulfonamide

  • Molecular FormulaC16H17N3O7S2
  • Average mass427.452 Da
  • Monoisotopic mass427.050781 Da
  • ChemSpider ID30239888

More details:

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

Benzenesulfonamide, N-[5-[(cyclopropylamino)sulfonyl]-2-hydroxyphenyl]-2-methyl-3-nitro- [ACD/Index Name]
N-[5-(Cyclopropylsulfamoyl)-2-hydroxyphenyl]-2-methyl-3-nitrobenzenesulfonamide [ACD/IUPAC Name]
N-[5-(Cyclopropylsulfamoyl)-2-hydroxyphényl]-2-méthyl-3-nitrobenzènesulfonamide [French] [ACD/IUPAC Name]
N-[5-(Cyclopropylsulfamoyl)-2-hydroxyphenyl]-2-methyl-3-nitrobenzolsulfonamid [German] [ACD/IUPAC Name]
N-[5-(CYCLOPROPYLSULFAMOYL)-2-HYDROXYPHENYL]-2-METHYL-3-NITROBENZENE-1-SULFONAMIDE

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

Density: 1.7±0.1 g/cm3
Boiling Point: 639.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.8±3.0 kJ/mol
Flash Point: 340.3±34.3 °C
Index of Refraction: 1.703
Molar Refractivity: 100.4±0.4 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 28.91
ACD/KOC (pH 5.5): 381.50
ACD/LogD (pH 7.4): 1.56
ACD/BCF (pH 7.4): 6.10
ACD/KOC (pH 7.4): 80.49
Polar Surface Area: 175 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 87.0±5.0 dyne/cm
Molar Volume: 258.9±5.0 cm3

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