ChemSpider 2D Image | Ethyl 4-[({[2-(3-fluorophenyl)-1-pyrrolidinyl]carbonyl}amino)methyl]cyclohexanecarboxylate | C21H29FN2O3

Ethyl 4-[({[2-(3-fluorophenyl)-1-pyrrolidinyl]carbonyl}amino)methyl]cyclohexanecarboxylate

  • Molecular FormulaC21H29FN2O3
  • Average mass376.465 Da
  • Monoisotopic mass376.216217 Da
  • ChemSpider ID24752739

More details:

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

4-[({[2-(3-Fluorophényl)-1-pyrrolidinyl]carbonyl}amino)méthyl]cyclohexanecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 4-[[[[2-(3-fluorophenyl)-1-pyrrolidinyl]carbonyl]amino]methyl]-, ethyl ester [ACD/Index Name]
Ethyl 4-[({[2-(3-fluorophenyl)-1-pyrrolidinyl]carbonyl}amino)methyl]cyclohexanecarboxylate [ACD/IUPAC Name]
Ethyl-4-[({[2-(3-fluorphenyl)-1-pyrrolidinyl]carbonyl}amino)methyl]cyclohexancarboxylat [German] [ACD/IUPAC Name]
ethyl 4-({[2-(3-fluorophenyl)pyrrolidinyl]carbonylamino}methyl)cyclohexanecarboxylate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 517.8±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 266.9±28.2 °C
Index of Refraction: 1.531
Molar Refractivity: 100.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.83
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 796.52
ACD/KOC (pH 5.5): 4152.18
ACD/LogD (pH 7.4): 4.12
ACD/BCF (pH 7.4): 796.52
ACD/KOC (pH 7.4): 4152.17
Polar Surface Area: 59 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 43.1±3.0 dyne/cm
Molar Volume: 324.8±3.0 cm3

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