ChemSpider 2D Image | Ethyl 1-{[5-(1,1-dioxido-1,2-thiazinan-2-yl)-2-methoxyphenyl]sulfonyl}-3-piperidinecarboxylate | C19H28N2O7S2

Ethyl 1-{[5-(1,1-dioxido-1,2-thiazinan-2-yl)-2-methoxyphenyl]sulfonyl}-3-piperidinecarboxylate

  • Molecular FormulaC19H28N2O7S2
  • Average mass460.565 Da
  • Monoisotopic mass460.133789 Da
  • ChemSpider ID23402550

More details:

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

1-{[5-(1,1-Dioxydo-1,2-thiazinan-2-yl)-2-méthoxyphényl]sulfonyl}-3-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
3-Piperidinecarboxylic acid, 1-[[2-methoxy-5-(tetrahydro-1,1-dioxido-2H-1,2-thiazin-2-yl)phenyl]sulfonyl]-, ethyl ester [ACD/Index Name]
Ethyl 1-{[5-(1,1-dioxido-1,2-thiazinan-2-yl)-2-methoxyphenyl]sulfonyl}-3-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl 1-{[5-(1,1-dioxido-1,2-thiazinan-2-yl)-2-methoxyphenyl]sulfonyl}piperidine-3-carboxylate
Ethyl-1-{[5-(1,1-dioxido-1,2-thiazinan-2-yl)-2-methoxyphenyl]sulfonyl}-3-piperidincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 630.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 335.4±34.3 °C
Index of Refraction: 1.568
Molar Refractivity: 111.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.71
ACD/LogD (pH 5.5): 1.76
ACD/BCF (pH 5.5): 12.77
ACD/KOC (pH 5.5): 215.52
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 12.77
ACD/KOC (pH 7.4): 215.52
Polar Surface Area: 127 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 52.0±3.0 dyne/cm
Molar Volume: 341.7±3.0 cm3

Click to predict properties on the Chemicalize site


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