ChemSpider 2D Image | 4-[(3,4-Dichlorophenyl)sulfonyl]benzoic acid | C13H8Cl2O4S

4-[(3,4-Dichlorophenyl)sulfonyl]benzoic acid

  • Molecular FormulaC13H8Cl2O4S
  • Average mass331.171 Da
  • Monoisotopic mass329.952026 Da
  • ChemSpider ID28292650

More details:

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

4-[(3,4-Dichlorophenyl)sulfonyl]benzoic acid [ACD/IUPAC Name]
4-[(3,4-Dichlorphenyl)sulfonyl]benzoesäure [German] [ACD/IUPAC Name]
Acide 4-[(3,4-dichlorophényl)sulfonyl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(3,4-dichlorophenyl)sulfonyl]- [ACD/Index Name]
1083428-67-4 [RN]
4-((3,4-Dichlorophenyl)sulfonyl)benzoic acid
Benzoicacid,4-[(3,4-dichlorophenyl)sulfonyl]-

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

Density: 1.5±0.1 g/cm3
Boiling Point: 538.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.9±3.0 kJ/mol
Flash Point: 279.7±30.1 °C
Index of Refraction: 1.630
Molar Refractivity: 76.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.27
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 4.89
ACD/KOC (pH 5.5): 26.39
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.99
Polar Surface Area: 80 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 58.3±3.0 dyne/cm
Molar Volume: 214.2±3.0 cm3

Click to predict properties on the Chemicalize site


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