ChemSpider 2D Image | 7,3',4'-Trihydroxy-3-benzyl-2H-chromene | C16H14O4

7,3',4'-Trihydroxy-3-benzyl-2H-chromene

  • Molecular FormulaC16H14O4
  • Average mass270.280 Da
  • Monoisotopic mass270.089203 Da
  • ChemSpider ID28295233

More details:

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

1,2-Benzenediol, 4-[(7-hydroxy-2H-1-benzopyran-3-yl)methyl]- [ACD/Index Name]
1111897-60-9 [RN]
4-[(7-Hydroxy-2H-chromen-3-yl)methyl]-1,2-benzenediol [ACD/IUPAC Name]
4-[(7-Hydroxy-2H-chromén-3-yl)méthyl]-1,2-benzènediol [French] [ACD/IUPAC Name]
4-[(7-Hydroxy-2H-chromen-3-yl)methyl]-1,2-benzoldiol [German] [ACD/IUPAC Name]
7,3',4'-Trihydroxy-3-benzyl-2H-chromene
[1111897-60-9] [RN]
4-((7-Hydroxy-2H-chromen-3-yl)methyl)benzene-1,2-diol
4-[(7-Hydroxy-2H-1-benzopyran-3-yl)methyl]benzene-1,2-diol
4-[(7-hydroxy-2H-chromen-3-yl)methyl]benzene-1,2-diol
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 540.8±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.9±3.0 kJ/mol
    Flash Point: 280.9±30.1 °C
    Index of Refraction: 1.702
    Molar Refractivity: 74.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.24
    ACD/LogD (pH 5.5): 2.76
    ACD/BCF (pH 5.5): 74.29
    ACD/KOC (pH 5.5): 759.99
    ACD/LogD (pH 7.4): 2.76
    ACD/BCF (pH 7.4): 73.41
    ACD/KOC (pH 7.4): 750.96
    Polar Surface Area: 70 Å2
    Polarizability: 29.5±0.5 10-24cm3
    Surface Tension: 70.2±3.0 dyne/cm
    Molar Volume: 192.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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