ChemSpider 2D Image | (4S,8Z)-11,13-Dihydroxy-4-methyl-4,5,6,7-tetrahydro-2H-3-benzoxacyclododecine-2,10(1H)-dione | C16H18O5

(4S,8Z)-11,13-Dihydroxy-4-methyl-4,5,6,7-tetrahydro-2H-3-benzoxacyclododecine-2,10(1H)-dione

  • Molecular FormulaC16H18O5
  • Average mass290.311 Da
  • Monoisotopic mass290.115417 Da
  • ChemSpider ID26377504
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(4S,8Z)-11,13-Dihydroxy-4-methyl-4,5,6,7-tetrahydro-2H-3-benzoxacyclododecin-2,10(1H)-dion [German] [ACD/IUPAC Name]
(4S,8Z)-11,13-Dihydroxy-4-methyl-4,5,6,7-tetrahydro-2H-3-benzoxacyclododecine-2,10(1H)-dione [ACD/IUPAC Name]
(4S,8Z)-11,13-Dihydroxy-4-méthyl-4,5,6,7-tétrahydro-2H-3-benzoxacyclododécine-2,10(1H)-dione [French] [ACD/IUPAC Name]
2H-3-Benzoxacyclododecin-2,10(1H)-dione, 4,5,6,7-tetrahydro-11,13-dihydroxy-4-methyl-, (4S,8Z)- [ACD/Index Name]
(4S)-11,13-DIHYDROXY-4-METHYL-4,5,6,7-TETRAHYDRO-1H-3-BENZOXACYCLODODECINE-2,10-DIONE
(5S,9Z)-13,15-Dihydroxy-5-methyl-4-oxabicyclo[10.4.0]hexadeca-1(12),9,13,15-tetraene-3,11-dione
10,11-Dehydrocurvularin
1095588-70-7 [RN]
21178-57-4 [RN]
Dehydrocurvularin, 10,11-
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 576.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 89.5±3.0 kJ/mol
    Flash Point: 216.7±23.6 °C
    Index of Refraction: 1.555
    Molar Refractivity: 76.0±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 1.84
    ACD/LogD (pH 5.5): 3.13
    ACD/BCF (pH 5.5): 140.68
    ACD/KOC (pH 5.5): 1192.88
    ACD/LogD (pH 7.4): 2.69
    ACD/BCF (pH 7.4): 50.55
    ACD/KOC (pH 7.4): 428.65
    Polar Surface Area: 84 Å2
    Polarizability: 30.1±0.5 10-24cm3
    Surface Tension: 46.8±3.0 dyne/cm
    Molar Volume: 236.9±3.0 cm3

    Click to predict properties on the Chemicalize site






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