ChemSpider 2D Image | 6-Chloro-3-{[(~2~H_5_)-2-propen-1-ylsulfanyl]methyl}-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide | C11H9D5ClN3O4S3

6-Chloro-3-{[(2H5)-2-propen-1-ylsulfanyl]methyl}-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide

  • Molecular FormulaC11H9D5ClN3O4S3
  • Average mass388.925 Da
  • Monoisotopic mass388.014862 Da
  • ChemSpider ID48057833

  • Non-standard isotope - Non-standard isotope

More details:

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

1,1-Dioxyde de 6-chloro-3-{[(2H5)-2-propén-1-ylsulfanyl]méthyl}-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide [French] [ACD/IUPAC Name]
2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3,4-dihydro-3-[(2-propen-1-yl-d5-thio)methyl]-, 1,1-dioxide [ACD/Index Name]
6-Chlor-3-{[(2H5)-2-propen-1-ylsulfanyl]methyl}-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-sulfonamid-1,1-dioxid [German] [ACD/IUPAC Name]
6-Chloro-3-{[(2H5)-2-propen-1-ylsulfanyl]methyl}-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide [ACD/IUPAC Name]
1329837-71-9 [RN]
6-chloro-1,1-dioxo-3-(1,1,2,3,3-pentadeuterioprop-2-enylsulfanylmethyl)-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 625.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.6±3.0 kJ/mol
Flash Point: 332.3±34.3 °C
Index of Refraction: 1.614
Molar Refractivity: 89.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.11
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 4.01
ACD/KOC (pH 5.5): 94.05
ACD/LogD (pH 7.4): 1.05
ACD/BCF (pH 7.4): 3.62
ACD/KOC (pH 7.4): 84.77
Polar Surface Area: 160 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 54.2±3.0 dyne/cm
Molar Volume: 255.4±3.0 cm3

Click to predict properties on the Chemicalize site


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