ChemSpider 2D Image | 2,6-Dimethyl-2,4-heptanediol | C9H20O2

2,6-Dimethyl-2,4-heptanediol

  • Molecular FormulaC9H20O2
  • Average mass160.254 Da
  • Monoisotopic mass160.146332 Da
  • ChemSpider ID57325443

More details:

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

2,4-Heptanediol, 2,6-dimethyl- [ACD/Index Name]
2,6-Dimethyl-2,4-heptandiol [German] [ACD/IUPAC Name]
2,6-Dimethyl-2,4-heptanediol [ACD/IUPAC Name]
2,6-Diméthyl-2,4-heptanediol [French] [ACD/IUPAC Name]
2,6-Dimethylheptane-2,4-diol
73264-93-4 [RN]
MFCD28362046

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

    Density: 0.9±0.1 g/cm3
    Boiling Point: 235.3±8.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 54.9±6.0 kJ/mol
    Flash Point: 100.7±13.0 °C
    Index of Refraction: 1.453
    Molar Refractivity: 46.7±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.41
    ACD/LogD (pH 5.5): 1.87
    ACD/BCF (pH 5.5): 15.62
    ACD/KOC (pH 5.5): 248.96
    ACD/LogD (pH 7.4): 1.87
    ACD/BCF (pH 7.4): 15.62
    ACD/KOC (pH 7.4): 248.96
    Polar Surface Area: 40 Å2
    Polarizability: 18.5±0.5 10-24cm3
    Surface Tension: 32.7±3.0 dyne/cm
    Molar Volume: 172.9±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement