ChemSpider 2D Image | Olean-13(18)-en-3-one | C30H48O

Olean-13(18)-en-3-one

  • Molecular FormulaC30H48O
  • Average mass424.702 Da
  • Monoisotopic mass424.370514 Da
  • ChemSpider ID28424326

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

20248-08-2 [RN]
Olean-13(18)-en-3-on [German] [ACD/IUPAC Name]
Olean-13(18)-en-3-one [ACD/Index Name] [ACD/IUPAC Name]
Oléan-13(18)-én-3-one [French] [ACD/IUPAC Name]
(4aR,6aR,6bS,8aR,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-octamethyl-2,4a,5,6,7,8,9,10,12,13,14,14a-dodecahydro-1H-picen-3-one
13(18)-Oleanen-3-one
MFCD20260471 [MDL number]
δ-amyrone

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 488.8±44.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.5±3.0 kJ/mol
    Flash Point: 203.1±23.4 °C
    Index of Refraction: 1.534
    Molar Refractivity: 130.3±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 1
    ACD/LogP: 10.51
    ACD/LogD (pH 5.5): 10.12
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 7645404.00
    ACD/LogD (pH 7.4): 10.12
    ACD/BCF (pH 7.4): 1000000.00
    ACD/KOC (pH 7.4): 7645404.00
    Polar Surface Area: 17 Å2
    Polarizability: 51.7±0.5 10-24cm3
    Surface Tension: 38.4±5.0 dyne/cm
    Molar Volume: 419.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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