ChemSpider 2D Image | 2-[(1S)-1-(4-Hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)propyl]-4-[3-(4-hydroxyphenyl)propyl]-5-methoxyphenol | C32H34O6

2-[(1S)-1-(4-Hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)propyl]-4-[3-(4-hydroxyphenyl)propyl]-5-methoxyphenol

  • Molecular FormulaC32H34O6
  • Average mass514.609 Da
  • Monoisotopic mass514.235535 Da
  • ChemSpider ID107561949

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-[(1S)-1-(4-Hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)propyl]-4-[3-(4-hydroxyphenyl)propyl]-5-methoxyphenol [German] [ACD/IUPAC Name]
2-[(1S)-1-(4-Hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)propyl]-4-[3-(4-hydroxyphenyl)propyl]-5-methoxyphenol [ACD/IUPAC Name]
2-[(1S)-1-(4-Hydroxy-2-méthoxyphényl)-3-(4-hydroxyphényl)propyl]-4-[3-(4-hydroxyphényl)propyl]-5-méthoxyphénol [French] [ACD/IUPAC Name]
Phenol, 2-[(1S)-1-(4-hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)propyl]-4-[3-(4-hydroxyphenyl)propyl]-5-methoxy- [ACD/Index Name]
1627521-95-2 [RN]
Anemarrhena B

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

Density: 1.2±0.1 g/cm3
Boiling Point: 734.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.9±3.0 kJ/mol
Flash Point: 397.9±32.9 °C
Index of Refraction: 1.636
Molar Refractivity: 148.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 6.37
ACD/LogD (pH 5.5): 5.92
ACD/BCF (pH 5.5): 18485.24
ACD/KOC (pH 5.5): 39424.14
ACD/LogD (pH 7.4): 5.91
ACD/BCF (pH 7.4): 18278.34
ACD/KOC (pH 7.4): 38982.86
Polar Surface Area: 99 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 55.1±3.0 dyne/cm
Molar Volume: 415.0±3.0 cm3

Click to predict properties on the Chemicalize site


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