ChemSpider 2D Image | 3-Acetylphenyl 4-acetylbenzenesulfonate | C16H14O5S

3-Acetylphenyl 4-acetylbenzenesulfonate

  • Molecular FormulaC16H14O5S
  • Average mass318.344 Da
  • Monoisotopic mass318.056183 Da
  • ChemSpider ID22040490

More details:

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

3-Acetylphenyl 4-acetylbenzenesulfonate [ACD/IUPAC Name]
3-Acetylphenyl-4-acetylbenzolsulfonat [German] [ACD/IUPAC Name]
4-Acétylbenzènesulfonate de 3-acétylphényle [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 4-acetyl-, 3-acetylphenyl ester [ACD/Index Name]
3-ACETYLPHENYL 4-ACETYLBENZENE-1-SULFONATE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 516.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.9±3.0 kJ/mol
Flash Point: 266.2±30.1 °C
Index of Refraction: 1.570
Molar Refractivity: 80.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.65
ACD/LogD (pH 5.5): 2.46
ACD/BCF (pH 5.5): 43.98
ACD/KOC (pH 5.5): 522.24
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 43.98
ACD/KOC (pH 7.4): 522.24
Polar Surface Area: 86 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 47.0±3.0 dyne/cm
Molar Volume: 246.2±3.0 cm3

Click to predict properties on the Chemicalize site


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