ChemSpider 2D Image | 3-Isopropyl(4a,5,6,7,8,8a-~13~C_6_)-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide | C413C6H12N2O3S

3-Isopropyl(4a,5,6,7,8,8a-13C6)-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide

  • Molecular FormulaC413C6H12N2O3S
  • Average mass246.235 Da
  • Monoisotopic mass246.076996 Da
  • ChemSpider ID48058717
  • 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-4a,5,6,7,8,8a-13C6, 3-(1-methylethyl)-, 2,2-dioxide [ACD/Index Name]
2,2-Dioxyde de 3-isopropyl(4a,5,6,7,8,8a-13C6)-1H-2,1,3-benzothiadiazin-4(3H)-one [French] [ACD/IUPAC Name]
3-Isopropyl(4a,5,6,7,8,8a-13C6)-1H-2,1,3-benzothiadiazin-4(3H)-on-2,2-dioxid [German] [ACD/IUPAC Name]
3-Isopropyl(4a,5,6,7,8,8a-13C6)-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide [ACD/IUPAC Name]
1330188-66-3 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.583
Molar Refractivity: 59.7±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
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:
Polarizability: 23.7±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 178.5±3.0 cm3

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