ChemSpider 2D Image | 1-Benzyl 3-methyl 3-allyl-1,3-piperidinedicarboxylate | C18H23NO4

1-Benzyl 3-methyl 3-allyl-1,3-piperidinedicarboxylate

  • Molecular FormulaC18H23NO4
  • Average mass317.379 Da
  • Monoisotopic mass317.162720 Da
  • ChemSpider ID28574497

More details:

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

1,3-Piperidinedicarboxylic acid, 3-(2-propen-1-yl)-, 3-methyl 1-(phenylmethyl) ester [ACD/Index Name]
1363166-19-1 [RN]
1-Benzyl 3-methyl 3-allyl-1,3-piperidinedicarboxylate [ACD/IUPAC Name]
1-Benzyl-3-methyl-3-allyl-1,3-piperidindicarboxylat [German] [ACD/IUPAC Name]
3-Allyl-1,3-pipéridinedicarboxylate de 1-benzyle et de 3-méthyle [French] [ACD/IUPAC Name]
[1363166-19-1] [RN]
1-benzyl 3-methyl 3-allylpiperidine-1,3-dicarboxylate
3-(2-propen-1-yl)-1,3-Piperidinedicarboxylic acid 3-methyl 1-(phenylmethyl) ester
METHYL 1-CBZ-3-ALLYLPIPERIDINE-3-CARBOXYLATE
MFCD21641323 [MDL number]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 417.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.0±3.0 kJ/mol
    Flash Point: 206.0±28.7 °C
    Index of Refraction: 1.528
    Molar Refractivity: 86.6±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 3.39
    ACD/LogD (pH 5.5): 3.39
    ACD/BCF (pH 5.5): 221.92
    ACD/KOC (pH 5.5): 1663.46
    ACD/LogD (pH 7.4): 3.39
    ACD/BCF (pH 7.4): 221.92
    ACD/KOC (pH 7.4): 1663.46
    Polar Surface Area: 56 Å2
    Polarizability: 34.3±0.5 10-24cm3
    Surface Tension: 42.5±3.0 dyne/cm
    Molar Volume: 281.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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