ChemSpider 2D Image | (2E)-1-[5-Hydroxy-2-methyl-2-(4-methyl-3-penten-1-yl)-2H-chromen-6-yl]-3-[2-(4-methoxybenzoyl)-1-benzofuran-5-yl]-2-propen-1-one | C35H32O6

(2E)-1-[5-Hydroxy-2-methyl-2-(4-methyl-3-penten-1-yl)-2H-chromen-6-yl]-3-[2-(4-methoxybenzoyl)-1-benzofuran-5-yl]-2-propen-1-one

  • Molecular FormulaC35H32O6
  • Average mass548.625 Da
  • Monoisotopic mass548.219910 Da
  • ChemSpider ID29416883

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1-[5-Hydroxy-2-methyl-2-(4-methyl-3-penten-1-yl)-2H-chromen-6-yl]-3-[2-(4-methoxybenzoyl)-1-benzofuran-5-yl]-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-[5-Hydroxy-2-methyl-2-(4-methyl-3-penten-1-yl)-2H-chromen-6-yl]-3-[2-(4-methoxybenzoyl)-1-benzofuran-5-yl]-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-[5-Hydroxy-2-méthyl-2-(4-méthyl-3-pentén-1-yl)-2H-chromén-6-yl]-3-[2-(4-méthoxybenzoyl)-1-benzofuran-5-yl]-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-[5-hydroxy-2-methyl-2-(4-methyl-3-penten-1-yl)-2H-1-benzopyran-6-yl]-3-[2-(4-methoxybenzoyl)-5-benzofuranyl]-, (2E)- [ACD/Index Name]
(E)-1-(5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-2H-chromen-6-yl)-3-(2-(4-methoxybenzoyl)benzofuran-5-yl)prop-2-en-1-one

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

Density: 1.2±0.1 g/cm3
Boiling Point: 726.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.8±3.0 kJ/mol
Flash Point: 393.1±32.9 °C
Index of Refraction: 1.629
Molar Refractivity: 161.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 9.84
ACD/LogD (pH 5.5): 8.48
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 966658.06
ACD/LogD (pH 7.4): 8.05
ACD/BCF (pH 7.4): 602240.44
ACD/KOC (pH 7.4): 357455.28
Polar Surface Area: 86 Å2
Polarizability: 64.0±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 453.9±3.0 cm3

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