ChemSpider 2D Image | 4-[(1S,3aR,4S,6aR)-4-(4-Hydroxy-3-methoxyphenyl)(3,3a,4-~13~C_3_)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-2,6-dimethoxyphenol | C1813C3H24O7

4-[(1S,3aR,4S,6aR)-4-(4-Hydroxy-3-methoxyphenyl)(3,3a,4-13C3)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-2,6-dimethoxyphenol

  • Molecular FormulaC1813C3H24O7
  • Average mass391.389 Da
  • Monoisotopic mass391.162262 Da
  • ChemSpider ID9706032

  • defined stereocentres - 4 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

4-[(1S,3aR,4S,6aR)-4-(4-Hydroxy-3-methoxyphenyl)(3,3a,4-13C3)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-2,6-dimethoxyphenol [ACD/IUPAC Name]
4-[(1S,3aR,4S,6aR)-4-(4-Hydroxy-3-methoxyphenyl)(3,3a,4-13C3)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-2,6-dimethoxyphenol [German] [ACD/IUPAC Name]
4-[(1S,3aR,4S,6aR)-4-(4-Hydroxy-3-méthoxyphényl)(3,3a,4-13C3)tétrahydro-1H,3H-furo[3,4-c]furan-1-yl]-2,6-diméthoxyphénol [French] [ACD/IUPAC Name]
Phenol, 2,6-dimethoxy-4-[(1S,3aR,4S,6aR)-tetrahydro-4-(4-hydroxy-3-methoxyphenyl)-1H,3H-furo[3,4-c]furan-1-yl-3,3a,4-13C3]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.587
Molar Refractivity: 101.6±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 302.3±3.0 cm3

Click to predict properties on the Chemicalize site


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