ChemSpider 2D Image | {7-(1-Ethoxyethoxy)-2-[4-(1-ethoxyethoxy)-3-methoxyphenyl]-5-[(1E)-3-(1-ethoxyethoxy)-1-propen-1-yl]-1-benzofuran-3-yl}methanol | C31H42O9

{7-(1-Ethoxyethoxy)-2-[4-(1-ethoxyethoxy)-3-methoxyphenyl]-5-[(1E)-3-(1-ethoxyethoxy)-1-propen-1-yl]-1-benzofuran-3-yl}methanol

  • Molecular FormulaC31H42O9
  • Average mass558.660 Da
  • Monoisotopic mass558.282898 Da
  • ChemSpider ID9257405

  • Double-bond stereo - Double-bond stereo

More details:

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

{7-(1-Ethoxyethoxy)-2-[4-(1-ethoxyethoxy)-3-methoxyphenyl]-5-[(1E)-3-(1-ethoxyethoxy)-1-propen-1-yl]-1-benzofuran-3-yl}methanol [ACD/IUPAC Name]
{7-(1-Ethoxyethoxy)-2-[4-(1-ethoxyethoxy)-3-methoxyphenyl]-5-[(1E)-3-(1-ethoxyethoxy)-1-propen-1-yl]-1-benzofuran-3-yl}methanol [German] [ACD/IUPAC Name]
{7-(1-Éthoxyéthoxy)-2-[4-(1-éthoxyéthoxy)-3-méthoxyphényl]-5-[(1E)-3-(1-éthoxyéthoxy)-1-propén-1-yl]-1-benzofuran-3-yl}méthanol [French] [ACD/IUPAC Name]
3-Benzofuranmethanol, 7-(1-ethoxyethoxy)-2-[4-(1-ethoxyethoxy)-3-methoxyphenyl]-5-[(1E)-3-(1-ethoxyethoxy)-1-propen-1-yl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 629.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 334.7±31.5 °C
Index of Refraction: 1.552
Molar Refractivity: 156.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 4.37
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 821.13
ACD/KOC (pH 5.5): 4243.61
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 821.13
ACD/KOC (pH 7.4): 4243.61
Polar Surface Area: 98 Å2
Polarizability: 62.1±0.5 10-24cm3
Surface Tension: 40.1±3.0 dyne/cm
Molar Volume: 490.1±3.0 cm3

Click to predict properties on the Chemicalize site


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