ChemSpider 2D Image | 9-(3,4-Dimethyl-5-pentfuran-2-yl)nonanoic acid | C20H34O3

9-(3,4-Dimethyl-5-pentfuran-2-yl)nonanoic acid

  • Molecular FormulaC20H34O3
  • Average mass322.482 Da
  • Monoisotopic mass322.250793 Da
  • ChemSpider ID23255371

More details:

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

2-Furannonanoic acid, 3,4-dimethyl-5-pentyl- [ACD/Index Name]
57818-40-3 [RN]
9-(3,4-Dimethyl-5-pentfuran-2-yl)nonanoic acid
9-(3,4-Dimethyl-5-pentyl-2-furyl)nonanoic acid [ACD/IUPAC Name]
9-(3,4-Dimethyl-5-pentyl-2-furyl)nonansäure [German] [ACD/IUPAC Name]
9-(3,4-dimethyl-5-pentylfuran-2-yl)nonanoic acid
Acide 9-(3,4-diméthyl-5-pentyl-2-furyl)nonanoïque [French] [ACD/IUPAC Name]
10,13-epoxy-11,12-dimethyloctadeca-10,12-dienoic acid
3,4-Dimethyl-5-pentyl-2-furannonanoic Acid
9-(3,4-dimethyl-5-pentylfuran-2-yl)-nonanoic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 456.5±33.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.5±3.0 kJ/mol
    Flash Point: 229.9±25.4 °C
    Index of Refraction: 1.489
    Molar Refractivity: 95.2±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 13
    #Rule of 5 Violations: 1
    ACD/LogP: 7.49
    ACD/LogD (pH 5.5): 6.14
    ACD/BCF (pH 5.5): 17640.78
    ACD/KOC (pH 5.5): 22631.01
    ACD/LogD (pH 7.4): 4.35
    ACD/BCF (pH 7.4): 282.94
    ACD/KOC (pH 7.4): 362.98
    Polar Surface Area: 50 Å2
    Polarizability: 37.7±0.5 10-24cm3
    Surface Tension: 36.1±3.0 dyne/cm
    Molar Volume: 330.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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