ChemSpider 2D Image | 6-Bromo-3,3-dichloro-1-methyl-1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide | C9H6BrCl2NO3S

6-Bromo-3,3-dichloro-1-methyl-1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide

  • Molecular FormulaC9H6BrCl2NO3S
  • Average mass359.024 Da
  • Monoisotopic mass356.862885 Da
  • ChemSpider ID24742453

More details:

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

1H-2,1-Benzothiazin-4(3H)-one, 6-bromo-3,3-dichloro-1-methyl-, 2,2-dioxide [ACD/Index Name]
2,2-Dioxyde de 6-bromo-3,3-dichloro-1-méthyl-1H-2,1-benzothiazin-4(3H)-one [French] [ACD/IUPAC Name]
6-Brom-3,3-dichlor-1-methyl-1H-2,1-benzothiazin-4(3H)-on-2,2-dioxid [German] [ACD/IUPAC Name]
6-Bromo-3,3-dichloro-1-methyl-1H-2,1-benzothiazin-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: 2.0±0.1 g/cm3
Boiling Point: 470.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 238.0±31.5 °C
Index of Refraction: 1.690
Molar Refractivity: 68.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.89
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 30.89
ACD/KOC (pH 5.5): 405.50
ACD/LogD (pH 7.4): 2.26
ACD/BCF (pH 7.4): 30.89
ACD/KOC (pH 7.4): 405.50
Polar Surface Area: 63 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 74.5±5.0 dyne/cm
Molar Volume: 180.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement