ChemSpider 2D Image | 3-(~2~H_3_)Methyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide | C8H5D3N2O3S

3-(2H3)Methyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide

  • Molecular FormulaC8H5D3N2O3S
  • Average mass215.244 Da
  • Monoisotopic mass215.044388 Da
  • ChemSpider ID10586252

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-2,1,3-Benzothiadiazin-4(3H)-one, 3-(methyl-d3)-, 2,2-dioxide [ACD/Index Name]
2,2-Dioxyde de 3-(2H3)méthyl-1H-2,1,3-benzothiadiazin-4(3H)-one [French] [ACD/IUPAC Name]
3-(2H3)Methyl-1H-2,1,3-benzothiadiazin-4(3H)-on-2,2-dioxid [German] [ACD/IUPAC Name]
3-(2H3)Methyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 388.0±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.7±3.0 kJ/mol
Flash Point: 188.5±23.2 °C
Index of Refraction: 1.605
Molar Refractivity: 50.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.92
ACD/LogD (pH 5.5): -0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.45
ACD/LogD (pH 7.4): -0.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.43
Polar Surface Area: 75 Å2
Polarizability: 20.0±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 146.4±3.0 cm3

Click to predict properties on the Chemicalize site


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