ChemSpider 2D Image | (4R,5R,6S,7R,8S)-6-(Benzyloxy)-8-[(benzyloxy)methoxy]-10-[(4-methoxybenzyl)oxy]-5,7-dimethyl-1-decen-4-ol | C35H46O6

(4R,5R,6S,7R,8S)-6-(Benzyloxy)-8-[(benzyloxy)methoxy]-10-[(4-methoxybenzyl)oxy]-5,7-dimethyl-1-decen-4-ol

  • Molecular FormulaC35H46O6
  • Average mass562.736 Da
  • Monoisotopic mass562.329468 Da
  • ChemSpider ID9390209

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(4R,5R,6S,7R,8S)-6-(Benzyloxy)-8-[(benzyloxy)methoxy]-10-[(4-methoxybenzyl)oxy]-5,7-dimethyl-1-decen-4-ol [ACD/IUPAC Name]
(4R,5R,6S,7R,8S)-6-(Benzyloxy)-8-[(benzyloxy)methoxy]-10-[(4-methoxybenzyl)oxy]-5,7-dimethyl-1-decen-4-ol [German] [ACD/IUPAC Name]
(4R,5R,6S,7R,8S)-6-(Benzyloxy)-8-[(benzyloxy)méthoxy]-10-[(4-méthoxybenzyl)oxy]-5,7-diméthyl-1-décén-4-ol [French] [ACD/IUPAC Name]
1-Decen-4-ol, 10-[(4-methoxyphenyl)methoxy]-5,7-dimethyl-6-(phenylmethoxy)-8-[(phenylmethoxy)methoxy]-, (4R,5R,6S,7R,8S)- [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: 659.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.9±3.0 kJ/mol
Flash Point: 352.3±31.5 °C
Index of Refraction: 1.546
Molar Refractivity: 164.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 2
ACD/LogP: 7.74
ACD/LogD (pH 5.5): 7.47
ACD/BCF (pH 5.5): 279610.97
ACD/KOC (pH 5.5): 275560.84
ACD/LogD (pH 7.4): 7.47
ACD/BCF (pH 7.4): 279610.97
ACD/KOC (pH 7.4): 275560.84
Polar Surface Area: 66 Å2
Polarizability: 65.2±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 518.7±3.0 cm3

Click to predict properties on the Chemicalize site


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