ChemSpider 2D Image | (3S,4R)-3,4-Bis(4-hydroxy-3-methoxybenzyl)dihydro-2(3H)-furanone | C20H22O6

(3S,4R)-3,4-Bis(4-hydroxy-3-methoxybenzyl)dihydro-2(3H)-furanone

  • Molecular FormulaC20H22O6
  • Average mass358.385 Da
  • Monoisotopic mass358.141632 Da
  • ChemSpider ID113611694

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,4R)-3,4-Bis(4-hydroxy-3-methoxybenzyl)dihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
(3S,4R)-3,4-Bis(4-hydroxy-3-methoxybenzyl)dihydro-2(3H)-furanone [ACD/IUPAC Name]
(3S,4R)-3,4-Bis(4-hydroxy-3-méthoxybenzyl)dihydro-2(3H)-furanone [French] [ACD/IUPAC Name]
2(3H)-Furanone, dihydro-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]-, (3S,4R)- [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: 593.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 212.3±22.2 °C
Index of Refraction: 1.605
Molar Refractivity: 95.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.70
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 23.70
ACD/KOC (pH 5.5): 335.43
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 23.59
ACD/KOC (pH 7.4): 333.88
Polar Surface Area: 85 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 277.7±3.0 cm3

Click to predict properties on the Chemicalize site


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