ChemSpider 2D Image | Methyl 4-{[(methylsulfonyl)oxy]acetyl}benzoate | C11H12O6S

Methyl 4-{[(methylsulfonyl)oxy]acetyl}benzoate

  • Molecular FormulaC11H12O6S
  • Average mass272.274 Da
  • Monoisotopic mass272.035461 Da
  • ChemSpider ID62871176

More details:

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

4-{2-[(Méthylsulfonyl)oxy]acétyl}benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[2-[(methylsulfonyl)oxy]acetyl]-, methyl ester [ACD/Index Name]
Methyl 4-{[(methylsulfonyl)oxy]acetyl}benzoate [ACD/IUPAC Name]
Methyl-4-{[(methylsulfonyl)oxy]acetyl}benzoat [German] [ACD/IUPAC Name]
1474032-69-3 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 485.6±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.1±3.0 kJ/mol
Flash Point: 247.5±24.6 °C
Index of Refraction: 1.528
Molar Refractivity: 62.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.32
ACD/LogD (pH 5.5): 1.31
ACD/BCF (pH 5.5): 5.86
ACD/KOC (pH 5.5): 123.44
ACD/LogD (pH 7.4): 1.31
ACD/BCF (pH 7.4): 5.86
ACD/KOC (pH 7.4): 123.44
Polar Surface Area: 95 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 202.8±3.0 cm3

Click to predict properties on the Chemicalize site


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