ChemSpider 2D Image | [2'-(2-{4-[5-(1,3-Dioxolan-2-yl)-2-methoxyphenoxy]phenyl}ethyl)-2,4'-dimethoxy-4-biphenylyl]methanol | C33H34O7

[2'-(2-{4-[5-(1,3-Dioxolan-2-yl)-2-methoxyphenoxy]phenyl}ethyl)-2,4'-dimethoxy-4-biphenylyl]methanol

  • Molecular FormulaC33H34O7
  • Average mass542.619 Da
  • Monoisotopic mass542.230469 Da
  • ChemSpider ID8801681

More details:

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

[1,1'-Biphenyl]-4-methanol, 2'-[2-[4-[5-(1,3-dioxolan-2-yl)-2-methoxyphenoxy]phenyl]ethyl]-2,4'-dimethoxy- [ACD/Index Name]
[2'-(2-{4-[5-(1,3-Dioxolan-2-yl)-2-methoxyphenoxy]phenyl}ethyl)-2,4'-dimethoxy-4-biphenylyl]methanol [ACD/IUPAC Name]
[2'-(2-{4-[5-(1,3-Dioxolan-2-yl)-2-methoxyphenoxy]phenyl}ethyl)-2,4'-dimethoxy-4-biphenylyl]methanol [German] [ACD/IUPAC Name]
[2'-(2-{4-[5-(1,3-Dioxolan-2-yl)-2-méthoxyphénoxy]phényl}éthyl)-2,4'-diméthoxy-4-biphénylyl]méthanol [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 667.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 103.1±3.0 kJ/mol
Flash Point: 357.5±31.5 °C
Index of Refraction: 1.595
Molar Refractivity: 153.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.86
ACD/LogD (pH 5.5): 5.10
ACD/BCF (pH 5.5): 4396.05
ACD/KOC (pH 5.5): 14102.55
ACD/LogD (pH 7.4): 5.10
ACD/BCF (pH 7.4): 4396.04
ACD/KOC (pH 7.4): 14102.54
Polar Surface Area: 76 Å2
Polarizability: 60.7±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 450.2±3.0 cm3

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