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Search term: VCXJTJJKILEODV (Found by InChIKey (skeleton match))
ChemSpider 2D Image | TERT-BUTYL 4-((BENZYLAMINO)METHYL)-4-HYDROXYPIPERIDINE-1-CARBOXYLATE | C18H28N2O3

TERT-BUTYL 4-((BENZYLAMINO)METHYL)-4-HYDROXYPIPERIDINE-1-CARBOXYLATE

  • Molecular FormulaC18H28N2O3
  • Average mass320.427 Da
  • Monoisotopic mass320.209991 Da
  • ChemSpider ID29358849

More details:

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

1352925-68-8 [RN]
1-Piperidinecarboxylic acid, 4-hydroxy-4-[[(phenylmethyl)amino]methyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[(benzylamino)methyl]-4-hydroxy-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[(benzylamino)methyl]-4-hydroxy-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-[(Benzylamino)méthyl]-4-hydroxy-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
TERT-BUTYL 4-((BENZYLAMINO)METHYL)-4-HYDROXYPIPERIDINE-1-CARBOXYLATE
MFCD21099575
tert-butyl 4-[(benzylamino)methyl]-4-hydroxy-piperidine-1-carboxylate
tert-Butyl 4-[(benzylamino)methyl]-4-hydroxypiperidine-1-carboxylate
TERTBUTYL-4-((BENZYLAMINO)METHYL)-4-HYDROXYPIPERIDINE-1-CARBOXYLATE

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

CCRIS 4693 [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 442.1±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 73.7±3.0 kJ/mol
    Flash Point: 221.2±25.9 °C
    Index of Refraction: 1.542
    Molar Refractivity: 90.3±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.25
    ACD/LogD (pH 5.5): -0.21
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 1.04
    ACD/BCF (pH 7.4): 1.38
    ACD/KOC (pH 7.4): 13.93
    Polar Surface Area: 62 Å2
    Polarizability: 35.8±0.5 10-24cm3
    Surface Tension: 45.2±3.0 dyne/cm
    Molar Volume: 287.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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