ChemSpider 2D Image | 2-(4-Methoxybenzylidene)-1,3-benzodithiole 1,1,3,3-tetraoxide | C15H12O5S2

2-(4-Methoxybenzylidene)-1,3-benzodithiole 1,1,3,3-tetraoxide

  • Molecular FormulaC15H12O5S2
  • Average mass336.383 Da
  • Monoisotopic mass336.012604 Da
  • ChemSpider ID30657522

More details:

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

1,1,3,3-Tétraoxyde de 2-(4-méthoxybenzylidène)-1,3-benzodithiole [French] [ACD/IUPAC Name]
1,3-Benzodithiole, 2-[(4-methoxyphenyl)methylene]-, 1,1,3,3-tetraoxide [ACD/Index Name]
2-(4-Methoxybenzyliden)-1,3-benzodithiol-1,1,3,3-tetraoxid [German] [ACD/IUPAC Name]
2-(4-Methoxybenzylidene)-1,3-benzodithiole 1,1,3,3-tetraoxide [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 647.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 92.0±3.0 kJ/mol
Flash Point: 345.2±31.5 °C
Index of Refraction: 1.659
Molar Refractivity: 82.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.13
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 11.66
ACD/KOC (pH 5.5): 201.96
ACD/LogD (pH 7.4): 1.71
ACD/BCF (pH 7.4): 11.66
ACD/KOC (pH 7.4): 201.96
Polar Surface Area: 94 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 62.4±3.0 dyne/cm
Molar Volume: 223.5±3.0 cm3

Click to predict properties on the Chemicalize site


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