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Search term: 24845470 (Found by CSID)

ChemSpider 2D Image | 5,7-Dihydroxy-2-[3-(3-hydroxy-3-methylbutyl)-4-methoxyphenyl]-3,6-dimethoxy-4H-chromen-4-one | C23H26O8

5,7-Dihydroxy-2-[3-(3-hydroxy-3-methylbutyl)-4-methoxyphenyl]-3,6-dimethoxy-4H-chromen-4-one

  • Molecular FormulaC23H26O8
  • Average mass430.448 Da
  • Monoisotopic mass430.162781 Da
  • ChemSpider ID24845470

More details:






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

4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-[3-(3-hydroxy-3-methylbutyl)-4-methoxyphenyl]-3,6-dimethoxy- [ACD/Index Name]
5,7-Dihydroxy-2-[3-(3-hydroxy-3-methylbutyl)-4-methoxyphenyl]-3,6-dimethoxy-4H-chromen-4-on [German] [ACD/IUPAC Name]
5,7-Dihydroxy-2-[3-(3-hydroxy-3-methylbutyl)-4-methoxyphenyl]-3,6-dimethoxy-4H-chromen-4-one [ACD/IUPAC Name]
5,7-Dihydroxy-2-[3-(3-hydroxy-3-méthylbutyl)-4-méthoxyphényl]-3,6-diméthoxy-4H-chromén-4-one [French] [ACD/IUPAC Name]
Aliarin 4'-methyl ether

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

Density: 1.4±0.1 g/cm3
Boiling Point: 667.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 103.1±3.0 kJ/mol
Flash Point: 230.3±25.0 °C
Index of Refraction: 1.626
Molar Refractivity: 111.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 111.56
ACD/KOC (pH 5.5): 958.87
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 5.02
ACD/KOC (pH 7.4): 43.12
Polar Surface Area: 115 Å2
Polarizability: 44.2±0.5 10-24cm3
Surface Tension: 64.5±5.0 dyne/cm
Molar Volume: 314.8±5.0 cm3

Click to predict properties on the Chemicalize site






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