ChemSpider 2D Image | kuraridin | C26H30O6

kuraridin

  • Molecular FormulaC26H30O6
  • Average mass438.513 Da
  • Monoisotopic mass438.204254 Da
  • ChemSpider ID23290485
  • 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

(2E)-1-{2,4-Dihydroxy-3-[(2R)-2-isopropenyl-5-methyl-4-hexen-1-yl]-6-methoxyphenyl}-3-(2,4-dihydroxyphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-{2,4-Dihydroxy-3-[(2R)-2-isopropenyl-5-methyl-4-hexen-1-yl]-6-methoxyphenyl}-3-(2,4-dihydroxyphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-{2,4-Dihydroxy-3-[(2R)-2-isopropényl-5-méthyl-4-hexén-1-yl]-6-méthoxyphényl}-3-(2,4-dihydroxyphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
(2E)-1-{2,4-dihydroxy-6-methoxy-3-[(2R)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]phenyl}-3-(2,4-dihydroxyphenyl)prop-2-en-1-one
2-Propen-1-one, 1-[2,4-dihydroxy-6-methoxy-3-[(2R)-5-methyl-2-(1-methylethenyl)-4-hexen-1-yl]phenyl]-3-(2,4-dihydroxyphenyl)-, (2E)- [ACD/Index Name]
34981-25-4 [RN]
kuraridin
(E)-1-[2,4-dihydroxy-6-methoxy-3-[(2R)-5-methyl-2-prop-1-en-2-ylhex-4-enyl]phenyl]-3-(2,4-dihydroxyphenyl)prop-2-en-1-one
Kuraridine

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 660.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 100.8±3.0 kJ/mol
    Flash Point: 221.3±25.0 °C
    Index of Refraction: 1.623
    Molar Refractivity: 127.4±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 4
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 1
    ACD/LogP: 7.16
    ACD/LogD (pH 5.5): 6.06
    ACD/BCF (pH 5.5): 23541.48
    ACD/KOC (pH 5.5): 46414.29
    ACD/LogD (pH 7.4): 5.46
    ACD/BCF (pH 7.4): 5896.06
    ACD/KOC (pH 7.4): 11624.66
    Polar Surface Area: 107 Å2
    Polarizability: 50.5±0.5 10-24cm3
    Surface Tension: 51.8±3.0 dyne/cm
    Molar Volume: 361.1±3.0 cm3

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