ChemSpider 2D Image | 4-Chloro-2-methylphenyl 4-methyl-3-(methylsulfonyl)benzoate | C16H15ClO4S

4-Chloro-2-methylphenyl 4-methyl-3-(methylsulfonyl)benzoate

  • Molecular FormulaC16H15ClO4S
  • Average mass338.806 Da
  • Monoisotopic mass338.037964 Da
  • ChemSpider ID30503138

More details:

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

4-Chlor-2-methylphenyl-4-methyl-3-(methylsulfonyl)benzoat [German] [ACD/IUPAC Name]
4-Chloro-2-methylphenyl 4-methyl-3-(methylsulfonyl)benzoate [ACD/IUPAC Name]
4-Méthyl-3-(méthylsulfonyl)benzoate de 4-chloro-2-méthylphényle [French] [ACD/IUPAC Name]
Benzoic acid, 4-methyl-3-(methylsulfonyl)-, 4-chloro-2-methylphenyl ester [ACD/Index Name]
4-CHLORO-2-METHYLPHENYL 3-METHANESULFONYL-4-METHYLBENZOATE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 565.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.0±3.0 kJ/mol
Flash Point: 295.9±30.1 °C
Index of Refraction: 1.574
Molar Refractivity: 85.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 442.84
ACD/KOC (pH 5.5): 2727.66
ACD/LogD (pH 7.4): 3.79
ACD/BCF (pH 7.4): 442.84
ACD/KOC (pH 7.4): 2727.66
Polar Surface Area: 69 Å2
Polarizability: 33.9±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 259.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement