ChemSpider 2D Image | tert-Butyl 6-bromo-3-oxo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate | C18H22BrNO3

tert-Butyl 6-bromo-3-oxo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate

  • Molecular FormulaC18H22BrNO3
  • Average mass380.276 Da
  • Monoisotopic mass379.078308 Da
  • ChemSpider ID25027244

More details:

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

1160247-43-7 [RN]
2-Methyl-2-propanyl 6-bromo-3-oxo-2,3-dihydro-1'H-spiro[indene-1,4'-piperidine]-1'-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-6-brom-3-oxo-2,3-dihydro-1'H-spiro[indene-1,4'-piperidine]-1'-carboxylat [German] [ACD/IUPAC Name]
6-Bromo-3-oxo-2,3-dihydro-1'H-spiro[indene-1,4'-piperidine]-1'-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
Spiro[1H-indene-1,4'-piperidine]-1'-carboxylic acid, 6-bromo-2,3-dihydro-3-oxo-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl 6-bromo-3-oxo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate
AGN-PC-086FNX
AM804735
MFCD12198599
N1(CCC2(CC(=O)c3ccc(cc23)Br)CC1)C(=O)OC(C)(C)C
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 487.6±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.4±3.0 kJ/mol
    Flash Point: 248.7±28.7 °C
    Index of Refraction: 1.599
    Molar Refractivity: 91.8±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 4.11
    ACD/LogD (pH 5.5): 4.16
    ACD/BCF (pH 5.5): 861.14
    ACD/KOC (pH 5.5): 4390.61
    ACD/LogD (pH 7.4): 4.16
    ACD/BCF (pH 7.4): 861.14
    ACD/KOC (pH 7.4): 4390.61
    Polar Surface Area: 47 Å2
    Polarizability: 36.4±0.5 10-24cm3
    Surface Tension: 52.6±5.0 dyne/cm
    Molar Volume: 268.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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