ChemSpider 2D Image | S-Dodecyl (2,6-dioxo-4-piperidinyl)ethanethioate | C19H33NO3S

S-Dodecyl (2,6-dioxo-4-piperidinyl)ethanethioate

  • Molecular FormulaC19H33NO3S
  • Average mass355.535 Da
  • Monoisotopic mass355.218109 Da
  • ChemSpider ID24705602

More details:

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

(2,6-Dioxo-4-pipéridinyl)éthanethioate de S-dodécyle [French] [ACD/IUPAC Name]
4-Piperidineethanethioic acid, 2,6-dioxo-, S-dodecyl ester [ACD/Index Name]
S-Dodecyl (2,6-dioxo-4-piperidinyl)ethanethioate [ACD/IUPAC Name]
S-Dodecyl-(2,6-dioxo-4-piperidinyl)ethanthioat [German] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL492981/

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

Density: 1.0±0.1 g/cm3
Boiling Point: 507.9±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.8±3.0 kJ/mol
Flash Point: 261.0±22.6 °C
Index of Refraction: 1.494
Molar Refractivity: 99.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 6.33
ACD/LogD (pH 5.5): 5.76
ACD/BCF (pH 5.5): 13916.08
ACD/KOC (pH 5.5): 32174.91
ACD/LogD (pH 7.4): 5.76
ACD/BCF (pH 7.4): 13914.43
ACD/KOC (pH 7.4): 32171.09
Polar Surface Area: 89 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 39.1±3.0 dyne/cm
Molar Volume: 342.2±3.0 cm3

Click to predict properties on the Chemicalize site


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