ChemSpider 2D Image | (4aS,7S,7aR)-1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol | C15H24O

(4aS,7S,7aR)-1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol

  • Molecular FormulaC15H24O
  • Average mass220.350 Da
  • Monoisotopic mass220.182709 Da
  • ChemSpider ID28945026

  • defined stereocentres - 3 of 5 defined stereocentres

More details:

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

(4aS,7S,7aR)-1,1,7-Trimethyl-4-methylendecahydro-1H-cyclopropa[e]azulen-7-ol [German] [ACD/IUPAC Name]
(4aS,7S,7aR)-1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol [ACD/IUPAC Name]
(4aS,7S,7aR)-1,1,7-Triméthyl-4-méthylènedécahydro-1H-cyclopropa[e]azulén-7-ol [French] [ACD/IUPAC Name]
1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, (4aS,7S,7aR)- [ACD/Index Name]
1421312-29-9 [RN]
Epispathulenol

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 297.0±19.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 62.3±6.0 kJ/mol
    Flash Point: 123.9±13.7 °C
    Index of Refraction: 1.528
    Molar Refractivity: 66.4±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 4.45
    ACD/LogD (pH 5.5): 4.35
    ACD/BCF (pH 5.5): 1188.00
    ACD/KOC (pH 5.5): 5527.81
    ACD/LogD (pH 7.4): 4.35
    ACD/BCF (pH 7.4): 1188.00
    ACD/KOC (pH 7.4): 5527.81
    Polar Surface Area: 20 Å2
    Polarizability: 26.3±0.5 10-24cm3
    Surface Tension: 36.3±5.0 dyne/cm
    Molar Volume: 215.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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