ChemSpider 2D Image | 2-Methyl-2-propanyl 4-({[(1,1-dioxidotetrahydro-3-thiophenyl)(ethyl)carbamoyl]oxy}methyl)-1-piperidinecarboxylate | C18H32N2O6S

2-Methyl-2-propanyl 4-({[(1,1-dioxidotetrahydro-3-thiophenyl)(ethyl)carbamoyl]oxy}methyl)-1-piperidinecarboxylate

  • Molecular FormulaC18H32N2O6S
  • Average mass404.522 Da
  • Monoisotopic mass404.198120 Da
  • ChemSpider ID60396224

More details:

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

1-Piperidinecarboxylic acid, 4-[[[[ethyl(tetrahydro-1,1-dioxido-3-thienyl)amino]carbonyl]oxy]methyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-({[(1,1-dioxidotetrahydro-3-thiophenyl)(ethyl)carbamoyl]oxy}methyl)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-({[(1,1-dioxidotetrahydro-3-thiophenyl)(ethyl)carbamoyl]oxy}methyl)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-({[(1,1-Dioxydotétrahydro-3-thiophényl)(éthyl)carbamoyl]oxy}méthyl)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [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: 552.7±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 288.0±28.2 °C
Index of Refraction: 1.533
Molar Refractivity: 101.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.40
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.72
ACD/KOC (pH 5.5): 238.53
ACD/LogD (pH 7.4): 1.84
ACD/BCF (pH 7.4): 14.72
ACD/KOC (pH 7.4): 238.53
Polar Surface Area: 102 Å2
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 49.5±5.0 dyne/cm
Molar Volume: 327.1±5.0 cm3

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