ChemSpider 2D Image | (2E)-1-(5-Hydroxy-2,2-dimethyl-3,4-dihydro-2H-chromen-6-yl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one | C23H26O6

(2E)-1-(5-Hydroxy-2,2-dimethyl-3,4-dihydro-2H-chromen-6-yl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one

  • Molecular FormulaC23H26O6
  • Average mass398.449 Da
  • Monoisotopic mass398.172943 Da
  • ChemSpider ID48064048

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1-(5-Hydroxy-2,2-dimethyl-3,4-dihydro-2H-chromen-6-yl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-(5-Hydroxy-2,2-dimethyl-3,4-dihydro-2H-chromen-6-yl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-(5-Hydroxy-2,2-diméthyl-3,4-dihydro-2H-chromén-6-yl)-3-(3,4,5-triméthoxyphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-(3,4-dihydro-5-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-3-(3,4,5-trimethoxyphenyl)-, (2E)- [ACD/Index Name]
(E)-1-(5-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
1-(5-hydroxy-2,2-dimethyl-3,4-dihydro-2h-chromen-6-yl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one
1513925-67-1 [RN]
WAIJUCXDFOUPEM-SOFGYWHQSA-N

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 573.0±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 89.1±3.0 kJ/mol
    Flash Point: 196.1±23.6 °C
    Index of Refraction: 1.581
    Molar Refractivity: 112.1±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: 5.67
    ACD/LogD (pH 5.5): 4.69
    ACD/BCF (pH 5.5): 2164.21
    ACD/KOC (pH 5.5): 8476.96
    ACD/LogD (pH 7.4): 4.52
    ACD/BCF (pH 7.4): 1458.92
    ACD/KOC (pH 7.4): 5714.44
    Polar Surface Area: 74 Å2
    Polarizability: 44.5±0.5 10-24cm3
    Surface Tension: 44.6±3.0 dyne/cm
    Molar Volume: 336.5±3.0 cm3

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