ChemSpider 2D Image | 4-Hydroxy-3-(3-methyl-2-butenoyl)-5-(3-methyl-2-butenyl)benzoic acid | C17H20O4

4-Hydroxy-3-(3-methyl-2-butenoyl)-5-(3-methyl-2-butenyl)benzoic acid

  • Molecular FormulaC17H20O4
  • Average mass288.338 Da
  • Monoisotopic mass288.136169 Da
  • ChemSpider ID26536850

More details:

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

155051-85-7 [RN]
4-Hydroxy-3-(3-methyl-2-butenoyl)-5-(3-methyl-2-buten-1-yl)benzoesäure [German] [ACD/IUPAC Name]
4-Hydroxy-3-(3-methyl-2-butenoyl)-5-(3-methyl-2-buten-1-yl)benzoic acid [ACD/IUPAC Name]
4-Hydroxy-3-(3-methyl-2-butenoyl)-5-(3-methyl-2-butenyl)benzoic acid
Acide 4-hydroxy-3-(3-méthyl-2-butenoyl)-5-(3-méthyl-2-butén-1-yl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-hydroxy-3-(3-methyl-2-buten-1-yl)-5-(3-methyl-1-oxo-2-buten-1-yl)- [ACD/Index Name]
[155051-85-7] [RN]
4-Hydroxy-3-(3-methyl-2-butenoyl)-5-(3-methyl-2-butenyl)benzoicacid
4-HYDROXY-3-(3-METHYL-2-BUTEYL)-
4-Hydroxy-3-(3-methyl-2-buteyl)-5-(3-methyl-2-butenyl)benzoic acid
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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: 484.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.0±3.0 kJ/mol
    Flash Point: 260.8±25.2 °C
    Index of Refraction: 1.570
    Molar Refractivity: 82.2±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 5.25
    ACD/LogD (pH 5.5): 3.38
    ACD/BCF (pH 5.5): 102.24
    ACD/KOC (pH 5.5): 386.51
    ACD/LogD (pH 7.4): 1.63
    ACD/BCF (pH 7.4): 1.82
    ACD/KOC (pH 7.4): 6.88
    Polar Surface Area: 75 Å2
    Polarizability: 32.6±0.5 10-24cm3
    Surface Tension: 45.7±3.0 dyne/cm
    Molar Volume: 250.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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