ChemSpider 2D Image | 5-[4-(Phenylsulfonyl)phenyl]-1,3-benzodioxol-2-one | C19H12O5S

5-[4-(Phenylsulfonyl)phenyl]-1,3-benzodioxol-2-one

  • Molecular FormulaC19H12O5S
  • Average mass352.361 Da
  • Monoisotopic mass352.040558 Da
  • ChemSpider ID38240634

More details:

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

1,3-Benzodioxol-2-one, 5-[4-(phenylsulfonyl)phenyl]- [ACD/Index Name]
5-[4-(Phenylsulfonyl)phenyl]-1,3-benzodioxol-2-on [German] [ACD/IUPAC Name]
5-[4-(Phenylsulfonyl)phenyl]-1,3-benzodioxol-2-one [ACD/IUPAC Name]
5-[4-(Phénylsulfonyl)phényl]-1,3-benzodioxol-2-one [French] [ACD/IUPAC Name]
5-(4-BENZENESULFONYL-PHENYL)-BENZO[1,3]DIOXOL-2-ONE
MFCD11499297

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

Density: 1.4±0.1 g/cm3
Boiling Point: 545.9±39.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.5±3.0 kJ/mol
Flash Point: 283.9±27.1 °C
Index of Refraction: 1.647
Molar Refractivity: 91.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.59
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 280.51
ACD/KOC (pH 5.5): 1967.19
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 280.51
ACD/KOC (pH 7.4): 1967.19
Polar Surface Area: 78 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 250.8±3.0 cm3

Click to predict properties on the Chemicalize site


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