ChemSpider 2D Image | (3-Oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis-2-isopropyl-5-methyl-4,1-phenylene diacetate | C32H34O6

(3-Oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis-2-isopropyl-5-methyl-4,1-phenylene diacetate

  • Molecular FormulaC32H34O6
  • Average mass514.609 Da
  • Monoisotopic mass514.235535 Da
  • ChemSpider ID2347776

More details:

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

(3-Oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis-2-isopropyl-5-methyl-4,1-phenylen-diacetat [German] [ACD/IUPAC Name]
(3-Oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis-2-isopropyl-5-methyl-4,1-phenylene diacetate [ACD/IUPAC Name]
1(3H)-Isobenzofuranone, 3,3-bis[4-(acetyloxy)-2-methyl-5-(1-methylethyl)phenyl]- [ACD/Index Name]
Diacétate de (3-oxo-1,3-dihydro-2-benzofurane-1,1-diyl)bis-2-isopropyl-5-méthyl-4,1-phénylène [French] [ACD/IUPAC Name]
(3-oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis(2-isopropyl-5-methyl-4,1-phenylene) diacetate
(3-oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis-5-methyl-2-(propan-2-yl)benzene-4,1-diyl diacetate
[4-[1-(4-acetyloxy-2-methyl-5-propan-2-ylphenyl)-3-oxo-2-benzofuran-1-yl]-5-methyl-2-propan-2-ylphenyl] acetate
301327-03-7 [RN]
4-{1-[4-(acetyloxy)-5-isopropyl-2-methylphenyl]-3-oxo-1,3-dihydro-2-benzofuran-1-yl}-2-isopropyl-5-methylphenyl acetate
4-{1-[4-(ACETYLOXY)-5-ISOPROPYL-2-METHYLPHENYL]-3-OXO-2-BENZOFURAN-1-YL}-2-ISOPROPYL-5-METHYLPHENYL ACETATE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AG-205/07678051 [DBID]
BAS 00125537 [DBID]
ZINC05223866 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 577.7±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 86.5±3.0 kJ/mol
    Flash Point: 241.6±30.2 °C
    Index of Refraction: 1.572
    Molar Refractivity: 145.0±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 6.38
    ACD/LogD (pH 5.5): 6.64
    ACD/BCF (pH 5.5): 65604.43
    ACD/KOC (pH 5.5): 97620.61
    ACD/LogD (pH 7.4): 6.64
    ACD/BCF (pH 7.4): 65604.43
    ACD/KOC (pH 7.4): 97620.61
    Polar Surface Area: 79 Å2
    Polarizability: 57.5±0.5 10-24cm3
    Surface Tension: 44.6±3.0 dyne/cm
    Molar Volume: 440.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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