ChemSpider 2D Image | (2E)-1-[3-(2,4-Dihydroxybenzoyl)-4,6-dihydroxy-2-(4-hydroxyphenyl)-1-benzofuran-7-yl]-3-(4-hydroxyphenyl)-2-propen-1-one | C30H20O9

(2E)-1-[3-(2,4-Dihydroxybenzoyl)-4,6-dihydroxy-2-(4-hydroxyphenyl)-1-benzofuran-7-yl]-3-(4-hydroxyphenyl)-2-propen-1-one

  • Molecular FormulaC30H20O9
  • Average mass524.474 Da
  • Monoisotopic mass524.110718 Da
  • ChemSpider ID8182600

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1-[3-(2,4-Dihydroxybenzoyl)-4,6-dihydroxy-2-(4-hydroxyphenyl)-1-benzofuran-7-yl]-3-(4-hydroxyphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-[3-(2,4-Dihydroxybenzoyl)-4,6-dihydroxy-2-(4-hydroxyphenyl)-1-benzofuran-7-yl]-3-(4-hydroxyphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-[3-(2,4-Dihydroxybenzoyl)-4,6-dihydroxy-2-(4-hydroxyphényl)-1-benzofuran-7-yl]-3-(4-hydroxyphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-[3-(2,4-dihydroxybenzoyl)-4,6-dihydroxy-2-(4-hydroxyphenyl)-7-benzofuranyl]-3-(4-hydroxyphenyl)-, (2E)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 746.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.7±3.0 kJ/mol
Flash Point: 405.5±32.9 °C
Index of Refraction: 1.780
Molar Refractivity: 142.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 5.65
ACD/LogD (pH 5.5): 4.42
ACD/BCF (pH 5.5): 1271.54
ACD/KOC (pH 5.5): 5450.01
ACD/LogD (pH 7.4): 2.54
ACD/BCF (pH 7.4): 16.85
ACD/KOC (pH 7.4): 72.21
Polar Surface Area: 169 Å2
Polarizability: 56.7±0.5 10-24cm3
Surface Tension: 84.1±3.0 dyne/cm
Molar Volume: 340.7±3.0 cm3

Click to predict properties on the Chemicalize site


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