ChemSpider 2D Image | 3,3'-[2,2-Propanediylbis(4,1-phenyleneoxy)]bis(3-phenoxy-1-propanol) | C33H36O6

3,3'-[2,2-Propanediylbis(4,1-phenyleneoxy)]bis(3-phenoxy-1-propanol)

  • Molecular FormulaC33H36O6
  • Average mass528.635 Da
  • Monoisotopic mass528.251160 Da
  • ChemSpider ID2299454

More details:






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

1-Propanol, 3,3'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis[3-phenoxy- [ACD/Index Name]
3,3'-[2,2-Propandiylbis(4,1-phenylenoxy)]bis(3-phenoxy-1-propanol) [German] [ACD/IUPAC Name]
3,3'-[2,2-Propanediylbis(4,1-phenyleneoxy)]bis(3-phenoxy-1-propanol) [ACD/IUPAC Name]
3,3'-[2,2-Propanediylbis(4,1-phénylèneoxy)]bis(3-phénoxy-1-propanol) [French] [ACD/IUPAC Name]
2,2-Bis(4-hydroxyphenyl)propane, phenyl glycidyl ether adduct
71230-68-7 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 706.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.5±3.0 kJ/mol
Flash Point: 381.0±32.9 °C
Index of Refraction: 1.591
Molar Refractivity: 151.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 8.13
ACD/LogD (pH 5.5): 6.27
ACD/BCF (pH 5.5): 34365.32
ACD/KOC (pH 5.5): 61452.41
ACD/LogD (pH 7.4): 6.27
ACD/BCF (pH 7.4): 34365.32
ACD/KOC (pH 7.4): 61452.41
Polar Surface Area: 77 Å2
Polarizability: 60.2±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 449.3±3.0 cm3

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