ChemSpider 2D Image | 4-[(4-Methyl-1,3-thiazol-5-yl)methyl]-1,3,4-oxathiazinane 3,3-dioxide | C8H12N2O3S2

4-[(4-Methyl-1,3-thiazol-5-yl)methyl]-1,3,4-oxathiazinane 3,3-dioxide

  • Molecular FormulaC8H12N2O3S2
  • Average mass248.322 Da
  • Monoisotopic mass248.028931 Da
  • ChemSpider ID29464945

More details:

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

3,3-Dioxyde de 4-[(4-méthyl-1,3-thiazol-5-yl)méthyl]-1,3,4-oxathiazinane [French] [ACD/IUPAC Name]
4-[(4-Methyl-1,3-thiazol-5-yl)methyl]-1,3,4-oxathiazinan-3,3-dioxid [German] [ACD/IUPAC Name]
4-[(4-Methyl-1,3-thiazol-5-yl)methyl]-1,3,4-oxathiazinane 3,3-dioxide [ACD/IUPAC Name]
4H-1,3,4-Oxathiazine, dihydro-4-[(4-methyl-5-thiazolyl)methyl]-, 3,3-dioxide [ACD/Index 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: 437.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 218.6±31.5 °C
Index of Refraction: 1.591
Molar Refractivity: 58.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.54
ACD/LogD (pH 5.5): 0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 27.65
ACD/LogD (pH 7.4): 0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 27.70
Polar Surface Area: 96 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 172.4±3.0 cm3

Click to predict properties on the Chemicalize site


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