ChemSpider 2D Image | Methyl N-[(benzyloxy)carbonyl]-D-phenylalaninate | C18H19NO4

Methyl N-[(benzyloxy)carbonyl]-D-phenylalaninate

  • Molecular FormulaC18H19NO4
  • Average mass313.348 Da
  • Monoisotopic mass313.131409 Da
  • ChemSpider ID26588858

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Phenylalanine, N-[(phenylmethoxy)carbonyl]-, methyl ester [ACD/Index Name]
Methyl N-[(benzyloxy)carbonyl]-D-phenylalaninate [ACD/IUPAC Name]
Methyl-N-[(benzyloxy)carbonyl]-D-phenylalaninat [German] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-D-phénylalaninate de méthyle [French] [ACD/IUPAC Name]
(R)-Methyl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate
37440-07-6 [RN]
Cbz-D-Phenylalanine methyl ester
CBZ-D-PHENYLALANINEMETHYLESTER
METHYL (2R)-2-{[(BENZYLOXY)CARBONYL]AMINO}-3-PHENYLPROPANOATE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 478.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.3±3.0 kJ/mol
Flash Point: 243.2±28.7 °C
Index of Refraction: 1.562
Molar Refractivity: 85.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.00
ACD/LogD (pH 5.5): 3.69
ACD/BCF (pH 5.5): 376.70
ACD/KOC (pH 5.5): 2429.44
ACD/LogD (pH 7.4): 3.69
ACD/BCF (pH 7.4): 376.60
ACD/KOC (pH 7.4): 2428.78
Polar Surface Area: 65 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 265.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement