ChemSpider 2D Image | Ethyl 1-[(4-chlorophenyl)carbamoyl]-4-(tetrahydro-2H-pyran-2-ylmethyl)-4-piperidinecarboxylate | C21H29ClN2O4

Ethyl 1-[(4-chlorophenyl)carbamoyl]-4-(tetrahydro-2H-pyran-2-ylmethyl)-4-piperidinecarboxylate

  • Molecular FormulaC21H29ClN2O4
  • Average mass408.919 Da
  • Monoisotopic mass408.181580 Da
  • ChemSpider ID22249385

More details:

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

1-[(4-Chlorophényl)carbamoyl]-4-(tétrahydro-2H-pyran-2-ylméthyl)-4-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[[(4-chlorophenyl)amino]carbonyl]-4-[(tetrahydro-2H-pyran-2-yl)methyl]-, ethyl ester [ACD/Index Name]
Ethyl 1-[(4-chlorophenyl)carbamoyl]-4-(tetrahydro-2H-pyran-2-ylmethyl)-4-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl-1-[(4-chlorphenyl)carbamoyl]-4-(tetrahydro-2H-pyran-2-ylmethyl)-4-piperidincarboxylat [German] [ACD/IUPAC Name]
ETHYL 1-[(4-CHLOROPHENYL)CARBAMOYL]-4-(OXAN-2-YLMETHYL)PIPERIDINE-4-CARBOXYLATE
ETHYL 1-[(4-CHLOROPHENYL)CARBAMOYL]-4-[(OXAN-2-YL)METHYL]PIPERIDINE-4-CARBOXYLATE
ethyl 1-{[(4-chlorophenyl)amino]carbonyl}-4-(tetrahydro-2H-pyran-2-ylmethyl)-4-piperidinecarboxylate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 569.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.4±3.0 kJ/mol
Flash Point: 298.0±30.1 °C
Index of Refraction: 1.565
Molar Refractivity: 108.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.73
ACD/LogD (pH 5.5): 3.95
ACD/BCF (pH 5.5): 590.05
ACD/KOC (pH 5.5): 3349.68
ACD/LogD (pH 7.4): 3.95
ACD/BCF (pH 7.4): 590.05
ACD/KOC (pH 7.4): 3349.69
Polar Surface Area: 68 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 331.7±3.0 cm3

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