ChemSpider 2D Image | (3R,3aS,6R,6aR)-3,6-Bis(1,3-benzodioxol-5-yl)tetrahydro-1H,3H-furo[3,4-c]furan-1-ol | C20H18O7

(3R,3aS,6R,6aR)-3,6-Bis(1,3-benzodioxol-5-yl)tetrahydro-1H,3H-furo[3,4-c]furan-1-ol

  • Molecular FormulaC20H18O7
  • Average mass370.353 Da
  • Monoisotopic mass370.105255 Da
  • ChemSpider ID26377603

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(3R,3aS,6R,6aR)-3,6-Bis(1,3-benzodioxol-5-yl)tetrahydro-1H,3H-furo[3,4-c]furan-1-ol [German] [ACD/IUPAC Name]
(3R,3aS,6R,6aR)-3,6-Bis(1,3-benzodioxol-5-yl)tetrahydro-1H,3H-furo[3,4-c]furan-1-ol [ACD/IUPAC Name]
(3R,3aS,6R,6aR)-3,6-Bis(1,3-benzodioxol-5-yl)tétrahydro-1H,3H-furo[3,4-c]furan-1-ol [French] [ACD/IUPAC Name]
1H,3H-Furo[3,4-c]furan-1-ol, 3,6-bis(1,3-benzodioxol-5-yl)tetrahydro-, (3R,3aS,6R,6aR)- [ACD/Index Name]
4-hydroxysesamin

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

Density: 1.5±0.1 g/cm3
Boiling Point: 558.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 291.3±30.1 °C
Index of Refraction: 1.646
Molar Refractivity: 91.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.84
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 31.75
ACD/KOC (pH 5.5): 413.55
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 31.75
ACD/KOC (pH 7.4): 413.55
Polar Surface Area: 76 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 66.7±3.0 dyne/cm
Molar Volume: 252.7±3.0 cm3

Click to predict properties on the Chemicalize site


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