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Search term: IJEYBHMKZANZCF (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 2,2'-Methylenebis{6-[2-hydroxy-3-(hydroxymethyl)-5-methylbenzyl]-4-methylphenol} | C33H36O6

2,2'-Methylenebis{6-[2-hydroxy-3-(hydroxymethyl)-5-methylbenzyl]-4-methylphenol}

  • Molecular FormulaC33H36O6
  • Average mass528.635 Da
  • Monoisotopic mass528.251160 Da
  • ChemSpider ID9115606

More details:






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

2,2'-Methylenbis{6-[2-hydroxy-3-(hydroxymethyl)-5-methylbenzyl]-4-methylphenol} [German] [ACD/IUPAC Name]
2,2'-Methylenebis{6-[2-hydroxy-3-(hydroxymethyl)-5-methylbenzyl]-4-methylphenol} [ACD/IUPAC Name]
2,2'-Méthylènebis{6-[2-hydroxy-3-(hydroxyméthyl)-5-méthylbenzyl]-4-méthylphénol} [French] [ACD/IUPAC Name]
Benzenemethanol, 3,3'-[methylenebis[(2-hydroxy-5-methyl-3,1-phenylene)methylene]]bis[2-hydroxy-5-methyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 744.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.8±3.0 kJ/mol
Flash Point: 312.6±26.1 °C
Index of Refraction: 1.666
Molar Refractivity: 153.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 4.71
ACD/LogD (pH 5.5): 4.84
ACD/BCF (pH 5.5): 2792.66
ACD/KOC (pH 5.5): 10191.68
ACD/LogD (pH 7.4): 4.83
ACD/BCF (pH 7.4): 2776.38
ACD/KOC (pH 7.4): 10132.26
Polar Surface Area: 121 Å2
Polarizability: 61.0±0.5 10-24cm3
Surface Tension: 61.2±3.0 dyne/cm
Molar Volume: 414.1±3.0 cm3

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