ChemSpider 2D Image | Methyl 2-benzyl-4-hydroxy-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide | C17H15NO5S

Methyl 2-benzyl-4-hydroxy-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide

  • Molecular FormulaC17H15NO5S
  • Average mass345.370 Da
  • Monoisotopic mass345.067108 Da
  • ChemSpider ID30656790

More details:

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

1,1-Dioxyde de 2-benzyl-4-hydroxy-2H-1,2-benzothiazine-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
2H-1,2-Benzothiazine-3-carboxylic acid, 4-hydroxy-2-(phenylmethyl)-, methyl ester, 1,1-dioxide [ACD/Index Name]
Methyl 2-benzyl-4-hydroxy-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide [ACD/IUPAC Name]
Methyl-2-benzyl-4-hydroxy-2H-1,2-benzothiazin-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: 538.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.9±3.0 kJ/mol
Flash Point: 279.7±32.9 °C
Index of Refraction: 1.669
Molar Refractivity: 88.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 8.27
ACD/KOC (pH 5.5): 79.91
ACD/LogD (pH 7.4): 0.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.38
Polar Surface Area: 92 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 66.9±3.0 dyne/cm
Molar Volume: 236.1±3.0 cm3

Click to predict properties on the Chemicalize site


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