ChemSpider 2D Image | 3-(4-Methoxyphenyl)-1lambda~4~,3,2-benzodithiazole-5-sulfonamide 1,1-dioxide | C13H12N2O5S3

3-(4-Methoxyphenyl)-1λ4,3,2-benzodithiazole-5-sulfonamide 1,1-dioxide

  • Molecular FormulaC13H12N2O5S3
  • Average mass372.440 Da
  • Monoisotopic mass371.990845 Da
  • ChemSpider ID28479212

More details:

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

1,1-Dioxyde de 3-(4-méthoxyphényl)-1λ4,3,2-benzodithiazole-5-sulfonamide [French] [ACD/IUPAC Name]
3-(4-Methoxyphenyl)-1λ4,3,2-benzodithiazol-5-sulfonamid-1,1-dioxid [German] [ACD/IUPAC Name]
3-(4-Methoxyphenyl)-1λ4,3,2-benzodithiazole-5-sulfonamide 1,1-dioxide [ACD/IUPAC Name]
3λ4-1,3,2-Benzodithiazole-5-sulfonamide, 3-(4-methoxyphenyl)-, 1,1-dioxide [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 694.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.8±3.0 kJ/mol
Flash Point: 374.0±34.3 °C
Index of Refraction: 1.755
Molar Refractivity: 88.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.28
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 152 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 83.5±7.0 dyne/cm
Molar Volume: 215.9±7.0 cm3

Click to predict properties on the Chemicalize site


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