ChemSpider 2D Image | Diethyl 1,1'-{sulfonylbis[4,1-phenyleneoxy(2-hydroxypropane-3,1-diyl)]}dipiperidine-4-carboxylate | C34H48N2O10S

Diethyl 1,1'-{sulfonylbis[4,1-phenyleneoxy(2-hydroxypropane-3,1-diyl)]}dipiperidine-4-carboxylate

  • Molecular FormulaC34H48N2O10S
  • Average mass676.817 Da
  • Monoisotopic mass676.302979 Da
  • ChemSpider ID12022869

More details:

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

1,1'-{Sulfonylbis[4,1-phénylèneoxy(2-hydroxy-3,1-propanediyl)]}di(4-pipéridinecarboxylate) de diéthyle [French] [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1,1'-[sulfonylbis[4,1-phenyleneoxy(2-hydroxy-3,1-propanediyl)]]bis-, diethyl ester [ACD/Index Name]
Diethyl 1,1'-{sulfonylbis[4,1-phenyleneoxy(2-hydroxy-3,1-propanediyl)]}di(4-piperidinecarboxylate) [ACD/IUPAC Name]
Diethyl 1,1'-{sulfonylbis[4,1-phenyleneoxy(2-hydroxypropane-3,1-diyl)]}dipiperidine-4-carboxylate
Diethyl-1,1'-{sulfonylbis[4,1-phenylenoxy(2-hydroxy-3,1-propandiyl)]}di(4-piperidincarboxylat) [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 807.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 123.1±3.0 kJ/mol
Flash Point: 442.2±34.3 °C
Index of Refraction: 1.562
Molar Refractivity: 176.0±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 4.35
ACD/LogD (pH 5.5): -0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.26
ACD/BCF (pH 7.4): 15.53
ACD/KOC (pH 7.4): 111.40
Polar Surface Area: 161 Å2
Polarizability: 69.8±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 542.9±3.0 cm3

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