ChemSpider 2D Image | (3S,4S)-3,4-Bis(3,4-dimethoxybenzyl)dihydro-2(3H)-furanone | C22H26O6

(3S,4S)-3,4-Bis(3,4-dimethoxybenzyl)dihydro-2(3H)-furanone

  • Molecular FormulaC22H26O6
  • Average mass386.438 Da
  • Monoisotopic mass386.172943 Da
  • ChemSpider ID57618174

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,4S)-3,4-Bis(3,4-dimethoxybenzyl)dihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
(3S,4S)-3,4-Bis(3,4-dimethoxybenzyl)dihydro-2(3H)-furanone [ACD/IUPAC Name]
(3S,4S)-3,4-Bis(3,4-diméthoxybenzyl)dihydro-2(3H)-furanone [French] [ACD/IUPAC Name]
2(3H)-Furanone, 3,4-bis[(3,4-dimethoxyphenyl)methyl]dihydro-, (3S,4S)- [ACD/Index Name]
3,4-BIS[(3,4-DIMETHOXYPHENYL)METHYL]OXOLAN-2-ONE
4773-01-7 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 545.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.5±3.0 kJ/mol
Flash Point: 237.2±28.8 °C
Index of Refraction: 1.553
Molar Refractivity: 105.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.23
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 107.51
ACD/KOC (pH 5.5): 990.22
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 107.51
ACD/KOC (pH 7.4): 990.22
Polar Surface Area: 63 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 43.4±3.0 dyne/cm
Molar Volume: 328.9±3.0 cm3

Click to predict properties on the Chemicalize site


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