ChemSpider 2D Image | 4,4'-(3-Oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis(2-isopropyl-5-methylphenolate) | C28H28O4

4,4'-(3-Oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis(2-isopropyl-5-methylphenolate)

  • Molecular FormulaC28H28O4
  • Average mass428.521 Da
  • Monoisotopic mass428.199860 Da
  • ChemSpider ID95636067

  • Charge - Charge

More details:

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

1(3H)-Isobenzofuranone, 3,3-bis[4-hydroxy-2-methyl-5-(1-methylethyl)phenyl]-, ion(2-) [ACD/Index Name]
4,4'-(3-Oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis(2-isopropyl-5-methylphenolat) [German] [ACD/IUPAC Name]
4,4'-(3-Oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis(2-isopropyl-5-methylphenolate) [ACD/IUPAC Name]
4,4'-(3-Oxo-1,3-dihydro-2-benzofurane-1,1-diyl)bis(2-isopropyl-5-méthylphénolate) [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 571.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.9±3.0 kJ/mol
Flash Point: 187.5±23.6 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.23
ACD/LogD (pH 5.5): 6.23
ACD/BCF (pH 5.5): 32114.80
ACD/KOC (pH 5.5): 58543.54
ACD/LogD (pH 7.4): 6.23
ACD/BCF (pH 7.4): 32016.26
ACD/KOC (pH 7.4): 58363.89
Polar Surface Area: 72 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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