ChemSpider 2D Image | (2E)-1-(3,4-Dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)-4-(2-methylphenyl)-4H-chromen-3-yl]-2-propen-1-one | C35H32O6

(2E)-1-(3,4-Dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)-4-(2-methylphenyl)-4H-chromen-3-yl]-2-propen-1-one

  • Molecular FormulaC35H32O6
  • Average mass548.625 Da
  • Monoisotopic mass548.219910 Da
  • ChemSpider ID4499504

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1-(3,4-Dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)-4-(2-methylphenyl)-4H-chromen-3-yl]-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-(3,4-Dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)-4-(2-methylphenyl)-4H-chromen-3-yl]-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-(3,4-Diméthoxyphényl)-3-[2-(3,4-diméthoxyphényl)-4-(2-méthylphényl)-4H-chromén-3-yl]-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-(3,4-dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)-4-(2-methylphenyl)-4H-1-benzopyran-3-yl]-, (2E)- [ACD/Index Name]
(E)-1-(3,4-dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)-4-(2-methylphenyl)-4H-chromen-3-yl]prop-2-en-1-one
326876-40-8 [RN]
5736-95-8 [RN]
FPAASFJJJJZWAD-WUKNDPDISA-N

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

AG-690/12887678 [DBID]
BAS 00834900 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 682.4±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 100.1±3.0 kJ/mol
    Flash Point: 284.5±31.5 °C
    Index of Refraction: 1.629
    Molar Refractivity: 160.8±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 2
    ACD/LogP: 7.60
    ACD/LogD (pH 5.5): 6.80
    ACD/BCF (pH 5.5): 87316.69
    ACD/KOC (pH 5.5): 119788.97
    ACD/LogD (pH 7.4): 6.80
    ACD/BCF (pH 7.4): 87316.69
    ACD/KOC (pH 7.4): 119788.97
    Polar Surface Area: 63 Å2
    Polarizability: 63.7±0.5 10-24cm3
    Surface Tension: 49.2±3.0 dyne/cm
    Molar Volume: 452.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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