ChemSpider 2D Image | 5'-bromo-1',2'-dihydrospiro[oxane-4,3'-pyrrolo[2,3-b]pyridin]-2'-one | C11H11BrN2O2

5'-bromo-1',2'-dihydrospiro[oxane-4,3'-pyrrolo[2,3-b]pyridin]-2'-one

  • Molecular FormulaC11H11BrN2O2
  • Average mass283.121 Da
  • Monoisotopic mass282.000397 Da
  • ChemSpider ID35519819

More details:

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

1341038-90-1 [RN]
5'-bromo-1',2'-dihydrospiro[oxane-4,3'-pyrrolo[2,3-b]pyridin]-2'-one
5'-Bromo-2,3,5,6-tetrahydrospiro[pyran-4,3'-pyrrolo[2,3-b]pyridin]-2'(1'H)-one [ACD/IUPAC Name]
Spiro[4H-pyran-4,3'-[3H]pyrrolo[2,3-b]pyridin]-2'(1'H)-one, 5'-bromo-2,3,5,6-tetrahydro- [ACD/Index Name]
5`-bromo-1`,2`-dihydrospiro[oxane-4,3`-pyrrolo[2,3-b]pyridine]-2`-one
5'-bromo-1',2'-dihydrospiro[oxane-4,3'-pyrrolo[2,3-b]pyridine]-2'-one
5-bromo-1,2-dihydrospiro[oxane-4,3-pyrrolo[2,3-b]pyridine]-2-one
5'-bromo-1'H-spiro[oxane-4,3'-pyrrolo[2,3-b]pyridin]-2'-one
MFCD28501856

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 468.6±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 73.1±3.0 kJ/mol
    Flash Point: 237.2±28.7 °C
    Index of Refraction: 1.653
    Molar Refractivity: 61.5±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 2.36
    ACD/LogD (pH 5.5): 2.34
    ACD/BCF (pH 5.5): 35.56
    ACD/KOC (pH 5.5): 448.49
    ACD/LogD (pH 7.4): 2.34
    ACD/BCF (pH 7.4): 35.54
    ACD/KOC (pH 7.4): 448.33
    Polar Surface Area: 51 Å2
    Polarizability: 24.4±0.5 10-24cm3
    Surface Tension: 66.6±5.0 dyne/cm
    Molar Volume: 168.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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