ChemSpider 2D Image | 2-Carbamoyl-3,4,5-trichloro-6-cyanobenzenesulfonic acid | C8H3Cl3N2O4S

2-Carbamoyl-3,4,5-trichloro-6-cyanobenzenesulfonic acid

  • Molecular FormulaC8H3Cl3N2O4S
  • Average mass329.544 Da
  • Monoisotopic mass327.887909 Da
  • ChemSpider ID95655003

More details:

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

2-Carbamoyl-3,4,5-trichlor-6-cyanbenzolsulfonsäure [German] [ACD/IUPAC Name]
2-Carbamoyl-3,4,5-trichloro-6-cyanobenzenesulfonic acid [ACD/IUPAC Name]
Acide 2-carbamoyl-3,4,5-trichloro-6-cyanobenzènesulfonique [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 2-(aminocarbonyl)-3,4,5-trichloro-6-cyano- [ACD/Index Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.698
Molar Refractivity: 64.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.55
ACD/LogD (pH 5.5): -2.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 130 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 102.9±5.0 dyne/cm
Molar Volume: 167.2±5.0 cm3

Click to predict properties on the Chemicalize site


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