ChemSpider 2D Image | tert-Butyl 4-(((benzyloxy)carbonyl)amino)-4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate | C21H30N2O6

tert-Butyl 4-(((benzyloxy)carbonyl)amino)-4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate

  • Molecular FormulaC21H30N2O6
  • Average mass406.473 Da
  • Monoisotopic mass406.210388 Da
  • ChemSpider ID29362304

More details:

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

1447606-52-1 [RN]
2-Methyl-2-propanyl 4-{[(benzyloxy)carbonyl]amino}-4-(2-methoxy-2-oxoethyl)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-{[(benzyloxy)carbonyl]amino}-4-(2-methoxy-2-oxoethyl)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-{[(Benzyloxy)carbonyl]amino}-4-(2-méthoxy-2-oxoéthyl)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
4-Piperidineacetic acid, 1-[(1,1-dimethylethoxy)carbonyl]-4-[[(phenylmethoxy)carbonyl]amino]-, methyl ester [ACD/Index Name]
tert-Butyl 4-(((benzyloxy)carbonyl)amino)-4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate
1-BOC-4-(CBZ-AMINO)-4-(2-METHOXY-2-OXOETHYL)PIPERIDINE
DS-12277
MFCD25541919
TERT-BUTYL 4-{[(BENZYLOXY)CARBONYL]AMINO}-4-(2-METHOXY-2-OXOETHYL)PIPERIDINE-1-CARBOXYLATE

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 523.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 79.7±3.0 kJ/mol
    Flash Point: 270.3±30.1 °C
    Index of Refraction: 1.543
    Molar Refractivity: 107.3±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 3.30
    ACD/LogD (pH 5.5): 3.48
    ACD/BCF (pH 5.5): 259.07
    ACD/KOC (pH 5.5): 1858.34
    ACD/LogD (pH 7.4): 3.48
    ACD/BCF (pH 7.4): 259.05
    ACD/KOC (pH 7.4): 1858.23
    Polar Surface Area: 94 Å2
    Polarizability: 42.5±0.5 10-24cm3
    Surface Tension: 48.6±5.0 dyne/cm
    Molar Volume: 340.4±5.0 cm3

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