ChemSpider 2D Image | (2S,4R,6S)-4,6-Bis[(4-methoxybenzyl)oxy]-10-phenyl-1,2-decanediol | C32H42O6

(2S,4R,6S)-4,6-Bis[(4-methoxybenzyl)oxy]-10-phenyl-1,2-decanediol

  • Molecular FormulaC32H42O6
  • Average mass522.672 Da
  • Monoisotopic mass522.298157 Da
  • ChemSpider ID9788099

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2S,4R,6S)-4,6-Bis[(4-methoxybenzyl)oxy]-10-phenyl-1,2-decandiol [German] [ACD/IUPAC Name]
(2S,4R,6S)-4,6-Bis[(4-methoxybenzyl)oxy]-10-phenyl-1,2-decanediol [ACD/IUPAC Name]
(2S,4R,6S)-4,6-Bis[(4-méthoxybenzyl)oxy]-10-phényl-1,2-décanediol [French] [ACD/IUPAC Name]
1,2-Decanediol, 4,6-bis[(4-methoxyphenyl)methoxy]-10-phenyl-, (2S,4R,6S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 672.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.8±3.0 kJ/mol
Flash Point: 360.7±31.5 °C
Index of Refraction: 1.562
Molar Refractivity: 150.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 6.06
ACD/LogD (pH 5.5): 5.91
ACD/BCF (pH 5.5): 18141.96
ACD/KOC (pH 5.5): 38900.30
ACD/LogD (pH 7.4): 5.91
ACD/BCF (pH 7.4): 18141.96
ACD/KOC (pH 7.4): 38900.30
Polar Surface Area: 77 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 465.6±3.0 cm3

Click to predict properties on the Chemicalize site


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