ChemSpider 2D Image | 4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)diphenolate | C19H12O5S

4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)diphenolate

  • Molecular FormulaC19H12O5S
  • Average mass352.362 Da
  • Monoisotopic mass352.041626 Da
  • ChemSpider ID95759699

  • Charge - Charge

More details:

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

4,4'-(1,1-Dioxido-3H-2,1-benzoxathiol-3,3-diyl)diphenolat [German] [ACD/IUPAC Name]
4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)diphenolate [ACD/IUPAC Name]
4,4'-(1,1-Dioxydo-3H-2,1-benzoxathiole-3,3-diyl)diphénolate [French] [ACD/IUPAC Name]
Phenol, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis-, ion(2-) [ACD/Index Name]

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

Density:
Boiling Point: 562.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.8±3.0 kJ/mol
Flash Point: 294.2±30.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 3.11
ACD/BCF (pH 5.5): 136.03
ACD/KOC (pH 5.5): 1170.47
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 101.84
ACD/KOC (pH 7.4): 876.32
Polar Surface Area: 98 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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