ChemSpider 2D Image | 2-{[4-(Carbamoylsulfamoyl)phenyl](methylsulfonyl)amino}octanoic acid | C16H25N3O7S2

2-{[4-(Carbamoylsulfamoyl)phenyl](methylsulfonyl)amino}octanoic acid

  • Molecular FormulaC16H25N3O7S2
  • Average mass435.516 Da
  • Monoisotopic mass435.113403 Da
  • ChemSpider ID102780911

More details:

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

2-{[4-(Carbamoylsulfamoyl)phenyl](methylsulfonyl)amino}octanoic acid [ACD/IUPAC Name]
2-{[4-(Carbamoylsulfamoyl)phenyl](methylsulfonyl)amino}octansäure [German] [ACD/IUPAC Name]
Acide 2-{[4-(carbamoylsulfamoyl)phényl](méthylsulfonyl)amino}octanoïque [French] [ACD/IUPAC Name]
Octanoic acid, 2-[[4-[[(aminocarbonyl)amino]sulfonyl]phenyl](methylsulfonyl)amino]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.582
Molar Refractivity: 103.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.05
ACD/LogD (pH 5.5): -1.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 181 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 62.2±3.0 dyne/cm
Molar Volume: 310.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement