ChemSpider 2D Image | 6-(Chloromethyl)-2-(4-morpholinyl)-1,4,3-oxathiazine 4,4-dioxide | C8H11ClN2O4S

6-(Chloromethyl)-2-(4-morpholinyl)-1,4,3-oxathiazine 4,4-dioxide

  • Molecular FormulaC8H11ClN2O4S
  • Average mass266.702 Da
  • Monoisotopic mass266.012817 Da
  • ChemSpider ID21414046

More details:






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

1,4,3-Oxathiazine, 6-(chloromethyl)-2-(4-morpholinyl)-, 4,4-dioxide [ACD/Index Name]
4,4-Dioxyde de 6-(chlorométhyl)-2-(4-morpholinyl)-1,4,3-oxathiazine [French] [ACD/IUPAC Name]
6-(Chlormethyl)-2-(4-morpholinyl)-1,4,3-oxathiazin-4,4-dioxid [German] [ACD/IUPAC Name]
6-(Chloromethyl)-2-(4-morpholinyl)-1,4,3-oxathiazine 4,4-dioxide [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 400.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.1±3.0 kJ/mol
Flash Point: 195.8±31.5 °C
Index of Refraction: 1.639
Molar Refractivity: 58.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.02
ACD/LogD (pH 5.5): -0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.15
ACD/LogD (pH 7.4): -0.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.15
Polar Surface Area: 77 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 61.9±7.0 dyne/cm
Molar Volume: 162.5±7.0 cm3

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