ChemSpider 2D Image | Methyl N-[(4-butylcyclohexyl)carbonyl]-N-(2-methoxyethyl)-beta-alaninate | C18H33NO4

Methyl N-[(4-butylcyclohexyl)carbonyl]-N-(2-methoxyethyl)-β-alaninate

  • Molecular FormulaC18H33NO4
  • Average mass327.459 Da
  • Monoisotopic mass327.240967 Da
  • ChemSpider ID27397124

More details:

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

Methyl N-[(4-butylcyclohexyl)carbonyl]-N-(2-methoxyethyl)-β-alaninate [ACD/IUPAC Name]
Methyl-N-[(4-butylcyclohexyl)carbonyl]-N-(2-methoxyethyl)-β-alaninat [German] [ACD/IUPAC Name]
N-[(4-Butylcyclohexyl)carbonyl]-N-(2-méthoxyéthyl)-β-alaninate de méthyle [French] [ACD/IUPAC Name]
β-Alanine, N-[(4-butylcyclohexyl)carbonyl]-N-(2-methoxyethyl)-, methyl ester [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 444.1±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 222.4±26.8 °C
Index of Refraction: 1.470
Molar Refractivity: 90.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 3.97
ACD/BCF (pH 5.5): 613.51
ACD/KOC (pH 5.5): 3444.48
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 613.51
ACD/KOC (pH 7.4): 3444.49
Polar Surface Area: 56 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 324.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement