ChemSpider 2D Image | 2-Methoxy-4-{(2R,3S)-7-methoxy-3-methyl-5-[(1E)-1-propen-1-yl]-2,3-dihydro-1-benzofuran-2-yl}phenol | C20H22O4

2-Methoxy-4-{(2R,3S)-7-methoxy-3-methyl-5-[(1E)-1-propen-1-yl]-2,3-dihydro-1-benzofuran-2-yl}phenol

  • Molecular FormulaC20H22O4
  • Average mass326.386 Da
  • Monoisotopic mass326.151794 Da
  • ChemSpider ID58840693

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

2-Methoxy-4-{(2R,3S)-7-methoxy-3-methyl-5-[(1E)-1-propen-1-yl]-2,3-dihydro-1-benzofuran-2-yl}phenol [German] [ACD/IUPAC Name]
2-Methoxy-4-{(2R,3S)-7-methoxy-3-methyl-5-[(1E)-1-propen-1-yl]-2,3-dihydro-1-benzofuran-2-yl}phenol [ACD/IUPAC Name]
2-Méthoxy-4-{(2R,3S)-7-méthoxy-3-méthyl-5-[(1E)-1-propén-1-yl]-2,3-dihydro-1-benzofuran-2-yl}phénol [French] [ACD/IUPAC Name]
Phenol, 4-[(2R,3S)-2,3-dihydro-7-methoxy-3-methyl-5-[(1E)-1-propen-1-yl]-2-benzofuranyl]-2-methoxy- [ACD/Index Name]
51020-86-1 [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: 452.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.8±3.0 kJ/mol
Flash Point: 227.2±28.7 °C
Index of Refraction: 1.596
Molar Refractivity: 95.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 3.97
ACD/BCF (pH 5.5): 618.51
ACD/KOC (pH 5.5): 3464.50
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 616.06
ACD/KOC (pH 7.4): 3450.79
Polar Surface Area: 48 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 281.2±3.0 cm3

Click to predict properties on the Chemicalize site


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