ChemSpider 2D Image | 2-Oxo-2,3-dihydro-1H-thieno[2,3-b][1,4]thiazine-6-carboxylic acid | C7H5NO3S2

2-Oxo-2,3-dihydro-1H-thieno[2,3-b][1,4]thiazine-6-carboxylic acid

  • Molecular FormulaC7H5NO3S2
  • Average mass215.249 Da
  • Monoisotopic mass214.971085 Da
  • ChemSpider ID26811638

More details:

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

1H-Thieno[2,3-b][1,4]thiazine-6-carboxylic acid, 2,3-dihydro-2-oxo- [ACD/Index Name]
2-Oxo-2,3-dihydro-1H-thieno[2,3-b][1,4]thiazin-6-carbonsäure [German] [ACD/IUPAC Name]
2-Oxo-2,3-dihydro-1H-thieno[2,3-b][1,4]thiazine-6-carboxylic acid [ACD/IUPAC Name]
Acide 2-oxo-2,3-dihydro-1H-thiéno[2,3-b][1,4]thiazine-6-carboxylique [French] [ACD/IUPAC Name]
426219-62-7 [RN]
MFCD22032707

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

Density: 1.7±0.1 g/cm3
Boiling Point: 523.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 84.0±3.0 kJ/mol
Flash Point: 270.6±30.1 °C
Index of Refraction: 1.708
Molar Refractivity: 50.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.95
ACD/LogD (pH 5.5): -0.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.82
ACD/LogD (pH 7.4): -1.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 120 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 75.2±3.0 dyne/cm
Molar Volume: 130.3±3.0 cm3

Click to predict properties on the Chemicalize site


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