ChemSpider 2D Image | Ethyl 3-[(4-chlorobenzyl)amino]-2-cyclohexyl-3-oxopropanoate | C18H24ClNO3

Ethyl 3-[(4-chlorobenzyl)amino]-2-cyclohexyl-3-oxopropanoate

  • Molecular FormulaC18H24ClNO3
  • Average mass337.841 Da
  • Monoisotopic mass337.144470 Da
  • ChemSpider ID21836719

More details:






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

3-[(4-Chlorobenzyl)amino]-2-cyclohexyl-3-oxopropanoate d'éthyle [French] [ACD/IUPAC Name]
Cyclohexaneacetic acid, α-[[[(4-chlorophenyl)methyl]amino]carbonyl]-, ethyl ester [ACD/Index Name]
Ethyl 3-[(4-chlorobenzyl)amino]-2-cyclohexyl-3-oxopropanoate [ACD/IUPAC Name]
Ethyl-3-[(4-chlorbenzyl)amino]-2-cyclohexyl-3-oxopropanoat [German] [ACD/IUPAC Name]
864437-10-5 [RN]
ETHYL 2-{[(4-CHLOROPHENYL)METHYL]CARBAMOYL}-2-CYCLOHEXYLACETATE
ethyl 3-((4-chlorobenzyl)amino)-2-cyclohexyl-3-oxopropanoate
ethyl 3-[(4-chlorophenyl)methylamino]-2-cyclohexyl-3-oxopropanoate
N-(4-Chloro-benzyl)-2-cyclohexyl-malonamic acid ethyl ester

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 512.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.4±3.0 kJ/mol
Flash Point: 263.9±27.3 °C
Index of Refraction: 1.534
Molar Refractivity: 90.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 4.52
ACD/BCF (pH 5.5): 1593.36
ACD/KOC (pH 5.5): 6820.47
ACD/LogD (pH 7.4): 4.52
ACD/BCF (pH 7.4): 1593.32
ACD/KOC (pH 7.4): 6820.31
Polar Surface Area: 55 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 43.9±3.0 dyne/cm
Molar Volume: 290.2±3.0 cm3

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