ChemSpider 2D Image | 7-[4-(Methoxycarbonyl)phenyl]-2-oxo-3,5,6,7-tetrahydro-2H-thiopyrano[2,3-d][1,3]thiazole-5,6-dicarboxylic acid | C16H13NO7S2

7-[4-(Methoxycarbonyl)phenyl]-2-oxo-3,5,6,7-tetrahydro-2H-thiopyrano[2,3-d][1,3]thiazole-5,6-dicarboxylic acid

  • Molecular FormulaC16H13NO7S2
  • Average mass395.407 Da
  • Monoisotopic mass395.013336 Da
  • ChemSpider ID30806056

More details:

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

2H-Thiopyrano[2,3-d]thiazole-5,6-dicarboxylic acid, 3,5,6,7-tetrahydro-7-[4-(methoxycarbonyl)phenyl]-2-oxo- [ACD/Index Name]
7-[4-(Methoxycarbonyl)phenyl]-2-oxo-3,5,6,7-tetrahydro-2H-thiopyrano[2,3-d][1,3]thiazol-5,6-dicarbonsäure [German] [ACD/IUPAC Name]
7-[4-(Methoxycarbonyl)phenyl]-2-oxo-3,5,6,7-tetrahydro-2H-thiopyrano[2,3-d][1,3]thiazole-5,6-dicarboxylic acid [ACD/IUPAC Name]
Acide 7-[4-(méthoxycarbonyl)phényl]-2-oxo-3,5,6,7-tétrahydro-2H-thiopyrano[2,3-d][1,3]thiazole-5,6-dicarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.725
Molar Refractivity: 93.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.17
ACD/LogD (pH 5.5): -0.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 181 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 90.8±5.0 dyne/cm
Molar Volume: 235.1±5.0 cm3

Click to predict properties on the Chemicalize site


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