ChemSpider 2D Image | (+)-Episyringaresinol | C22H26O8

(+)-Episyringaresinol

  • Molecular FormulaC22H26O8
  • Average mass418.437 Da
  • Monoisotopic mass418.162781 Da
  • ChemSpider ID34519201

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(+)-Episyringaresinol
21453-71-4 [RN]
4,4'-(1R,3aR,4S,6aR)-Tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diylbis(2,6-dimethoxyphenol) [German] [ACD/IUPAC Name]
4,4'-(1R,3aR,4S,6aR)-Tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diylbis(2,6-dimethoxyphenol) [ACD/IUPAC Name]
4,4'-(1R,3aR,4S,6aR)-Tétrahydro-1H,3H-furo[3,4-c]furane-1,4-diylbis(2,6-diméthoxyphénol) [French] [ACD/IUPAC Name]
Phenol, 4,4'-[(1R,3aR,4S,6aR)-tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diyl]bis[2,6-dimethoxy- [ACD/Index Name]
(+)-epi-syringaresinol
4-[(3R,3aR,6S,6aR)-6-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2,6-dimethoxyphenol
51152-20-6 [RN]
Episyringaresinol
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 594.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.9±3.0 kJ/mol
Flash Point: 313.5±30.1 °C
Index of Refraction: 1.578
Molar Refractivity: 108.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.71
ACD/LogD (pH 5.5): 1.35
ACD/BCF (pH 5.5): 6.23
ACD/KOC (pH 5.5): 128.87
ACD/LogD (pH 7.4): 1.35
ACD/BCF (pH 7.4): 6.18
ACD/KOC (pH 7.4): 127.97
Polar Surface Area: 96 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 48.6±3.0 dyne/cm
Molar Volume: 326.3±3.0 cm3

Click to predict properties on the Chemicalize site


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