Found 3 results

Search term: BXPBLRRKIQAMIP (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-Benzoylcyclopentanecarboxylic acid | C13H14O3

3-Benzoylcyclopentanecarboxylic acid

  • Molecular FormulaC13H14O3
  • Average mass218.249 Da
  • Monoisotopic mass218.094299 Da
  • ChemSpider ID26000756

More details:

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

3-Benzoylcyclopentancarbonsäure [German] [ACD/IUPAC Name]
3-Benzoylcyclopentanecarboxylic acid [ACD/IUPAC Name]
Acide 3-benzoylcyclopentanecarboxylique [French] [ACD/IUPAC Name]
Cyclopentanecarboxylic acid, 3-benzoyl- [ACD/Index Name]
1215032-39-5 [RN]
1401113-67-4 [RN]
3-BENZOYLCYCLOPENTANE-1-CARBOXYLIC ACID
732251-89-7 [RN]
cis-3-Benzoylcyclopentane-1-carboxylic acid
MFCD01311185 [MDL number]
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: 393.7±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.9±3.0 kJ/mol
    Flash Point: 206.1±22.4 °C
    Index of Refraction: 1.575
    Molar Refractivity: 58.8±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.82
    ACD/LogD (pH 5.5): 1.09
    ACD/BCF (pH 5.5): 2.27
    ACD/KOC (pH 5.5): 32.15
    ACD/LogD (pH 7.4): -0.71
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 54 Å2
    Polarizability: 23.3±0.5 10-24cm3
    Surface Tension: 52.0±3.0 dyne/cm
    Molar Volume: 178.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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