ChemSpider 2D Image | Methyl 4-hydroxy-2-isopropyl-2H-thieno[2,3-e][1,2]thiazine-3-carboxylate 1,1-dioxide | C11H13NO5S2

Methyl 4-hydroxy-2-isopropyl-2H-thieno[2,3-e][1,2]thiazine-3-carboxylate 1,1-dioxide

  • Molecular FormulaC11H13NO5S2
  • Average mass303.355 Da
  • Monoisotopic mass303.023499 Da
  • ChemSpider ID27455446

More details:

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

1,1-Dioxyde de 4-hydroxy-2-isopropyl-2H-thiéno[2,3-e][1,2]thiazine-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
2H-Thieno[2,3-e]-1,2-thiazine-3-carboxylic acid, 4-hydroxy-2-(1-methylethyl)-, methyl ester, 1,1-dioxide [ACD/Index Name]
Methyl 4-hydroxy-2-isopropyl-2H-thieno[2,3-e][1,2]thiazine-3-carboxylate 1,1-dioxide [ACD/IUPAC Name]
Methyl-4-hydroxy-2-isopropyl-2H-thieno[2,3-e][1,2]thiazin-3-carboxylat-1,1-dioxid [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 460.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.0±3.0 kJ/mol
Flash Point: 232.2±31.5 °C
Index of Refraction: 1.628
Molar Refractivity: 70.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.95
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 2.57
ACD/KOC (pH 5.5): 34.63
ACD/LogD (pH 7.4): -0.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 121 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 64.2±3.0 dyne/cm
Molar Volume: 199.4±3.0 cm3

Click to predict properties on the Chemicalize site


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