ChemSpider 2D Image | 1,1,4,4,7-pentamethylisochroman | C14H20O

1,1,4,4,7-pentamethylisochroman

  • Molecular FormulaC14H20O
  • Average mass204.308 Da
  • Monoisotopic mass204.151413 Da
  • ChemSpider ID24211978

More details:

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

1,1,4,4,7-Pentamethyl-3,4-dihydro-1H-isochromen [German] [ACD/IUPAC Name]
1,1,4,4,7-Pentamethyl-3,4-dihydro-1H-isochromene [ACD/IUPAC Name]
1,1,4,4,7-Pentaméthyl-3,4-dihydro-1H-isochromène [French] [ACD/IUPAC Name]
1,1,4,4,7-pentamethylisochroman
1H-2-Benzopyran, 3,4-dihydro-1,1,4,4,7-pentamethyl- [ACD/Index Name]
786690-10-6 [RN]
1,1,4,4,7-Pentamethyl-3,4-dihydro-1H-2-benzopyran
1,1,4,4,7-pentamethyl-3H-2-benzopyran
1,1,4,4,7-Pentamethyl-isochroman
1H-2-Benzopyran, 3,4-dihydro-1,1,4,4,7-pentamethyl- (9CI)
More...

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

    Density: 0.9±0.1 g/cm3
    Boiling Point: 275.8±9.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 49.4±3.0 kJ/mol
    Flash Point: 116.4±14.9 °C
    Index of Refraction: 1.488
    Molar Refractivity: 63.5±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 4.59
    ACD/LogD (pH 5.5): 4.62
    ACD/BCF (pH 5.5): 1903.17
    ACD/KOC (pH 5.5): 7745.47
    ACD/LogD (pH 7.4): 4.62
    ACD/BCF (pH 7.4): 1903.17
    ACD/KOC (pH 7.4): 7745.47
    Polar Surface Area: 9 Å2
    Polarizability: 25.2±0.5 10-24cm3
    Surface Tension: 31.4±3.0 dyne/cm
    Molar Volume: 220.4±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement