ChemSpider 2D Image | Methyl 6-(4-(((benzyloxy)carbonyl)amino)phenyl)picolinate | C21H18N2O4

Methyl 6-(4-(((benzyloxy)carbonyl)amino)phenyl)picolinate

  • Molecular FormulaC21H18N2O4
  • Average mass362.379 Da
  • Monoisotopic mass362.126648 Da
  • ChemSpider ID28535848

More details:

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

1381944-48-4 [RN]
2-Pyridinecarboxylic acid, 6-[4-[[(phenylmethoxy)carbonyl]amino]phenyl]-, methyl ester [ACD/Index Name]
6-(4-{[(Benzyloxy)carbonyl]amino}phényl)-2-pyridinecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 6-(4-(((benzyloxy)carbonyl)amino)phenyl)picolinate
Methyl 6-(4-{[(benzyloxy)carbonyl]amino}phenyl)-2-pyridinecarboxylate [ACD/IUPAC Name]
Methyl-6-(4-{[(benzyloxy)carbonyl]amino}phenyl)-2-pyridincarboxylat [German] [ACD/IUPAC Name]
[1381944-48-4] [RN]
LD-0713
METHYL 6-(4-{[(BENZYLOXY)CARBONYL]AMINO}PHENYL)PYRIDINE-2-CARBOXYLATE
Methyl 6-(4-Cbz-aminophenyl)pyridine-2-carboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 521.9±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 79.5±3.0 kJ/mol
    Flash Point: 269.5±30.1 °C
    Index of Refraction: 1.626
    Molar Refractivity: 101.2±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 3.47
    ACD/LogD (pH 5.5): 3.99
    ACD/BCF (pH 5.5): 635.50
    ACD/KOC (pH 5.5): 3532.20
    ACD/LogD (pH 7.4): 3.99
    ACD/BCF (pH 7.4): 635.64
    ACD/KOC (pH 7.4): 3532.96
    Polar Surface Area: 78 Å2
    Polarizability: 40.1±0.5 10-24cm3
    Surface Tension: 54.0±3.0 dyne/cm
    Molar Volume: 286.0±3.0 cm3

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