ChemSpider 2D Image | N-[(Benzyloxy)carbonyl]-N-methyl-D-phenylalanine | C18H19NO4

N-[(Benzyloxy)carbonyl]-N-methyl-D-phenylalanine

  • Molecular FormulaC18H19NO4
  • Average mass313.348 Da
  • Monoisotopic mass313.131409 Da
  • ChemSpider ID23919548

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-{[(BENZYLOXY)CARBONYL](METHYL)AMINO}-3-PHENYLPROPANOIC ACID
114526-00-0 [RN]
D-Phenylalanine, N-methyl-N-[(phenylmethoxy)carbonyl]- [ACD/Index Name]
N-[(Benzyloxy)carbonyl]-N-methyl-D-phenylalanin [German] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-N-methyl-D-phenylalanine [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-N-méthyl-D-phénylalanine [French] [ACD/IUPAC Name]
(R)-2-(((Benzyloxy)carbonyl)(methyl)amino)-3-phenylpropanoic acid
[114526-00-0] [RN]
Cbz-N-methyl-D-phenylalanine
Cbz-N-methyl-L-phenylalanine
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 485.0±44.0 °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: 247.1±28.4 °C
    Index of Refraction: 1.589
    Molar Refractivity: 85.8±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 4.07
    ACD/LogD (pH 5.5): 1.46
    ACD/BCF (pH 5.5): 2.44
    ACD/KOC (pH 5.5): 17.33
    ACD/LogD (pH 7.4): -0.04
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 67 Å2
    Polarizability: 34.0±0.5 10-24cm3
    Surface Tension: 52.2±3.0 dyne/cm
    Molar Volume: 254.7±3.0 cm3

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