ChemSpider 2D Image | tert-Butyl 3-oxo-1,2,3,5-tetrahydrospiro[benzo-[c]azepine-4,4'-piperidine]-1'-carboxylate | C19H26N2O3

tert-Butyl 3-oxo-1,2,3,5-tetrahydrospiro[benzo-[c]azepine-4,4'-piperidine]-1'-carboxylate

  • Molecular FormulaC19H26N2O3
  • Average mass330.421 Da
  • Monoisotopic mass330.194336 Da
  • ChemSpider ID28600672

More details:

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

1160247-91-5 [RN]
2-Methyl-2-propanyl 3-oxo-1,2,3,5-tetrahydro-1'H-spiro[2-benzazepine-4,4'-piperidine]-1'-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-oxo-1,2,3,5-tetrahydro-1'H-spiro[2-benzazepine-4,4'-piperidine]-1'-carboxylat [German] [ACD/IUPAC Name]
3-Oxo-1,2,3,5-tétrahydro-1'H-spiro[2-benzazepine-4,4'-piperidine]-1'-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
Spiro[4H-2-benzazepine-4,4'-piperidine]-1'-carboxylic acid, 1,2,3,5-tetrahydro-3-oxo-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl 3-oxo-1,2,3,5-tetrahydrospiro[benzo-[c]azepine-4,4'-piperidine]-1'-carboxylate
AM804864
Chemistry 7172
MFCD12198647
PB26804
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 525.8±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 80.0±3.0 kJ/mol
    Flash Point: 271.8±30.1 °C
    Index of Refraction: 1.574
    Molar Refractivity: 92.4±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.30
    ACD/LogD (pH 5.5): 2.61
    ACD/BCF (pH 5.5): 56.44
    ACD/KOC (pH 5.5): 624.29
    ACD/LogD (pH 7.4): 2.61
    ACD/BCF (pH 7.4): 56.44
    ACD/KOC (pH 7.4): 624.29
    Polar Surface Area: 59 Å2
    Polarizability: 36.6±0.5 10-24cm3
    Surface Tension: 49.3±5.0 dyne/cm
    Molar Volume: 279.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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