ChemSpider 2D Image | 5,7-Dihydroxy-8-(2-hydroxy-3-methyl-3-buten-1-yl)-3-(4-hydroxyphenyl)-6-(3-methyl-2-buten-1-yl)-4H-chromen-4-one | C25H26O6

5,7-Dihydroxy-8-(2-hydroxy-3-methyl-3-buten-1-yl)-3-(4-hydroxyphenyl)-6-(3-methyl-2-buten-1-yl)-4H-chromen-4-one

  • Molecular FormulaC25H26O6
  • Average mass422.470 Da
  • Monoisotopic mass422.172943 Da
  • ChemSpider ID24621035

More details:

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

4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-(2-hydroxy-3-methyl-3-buten-1-yl)-3-(4-hydroxyphenyl)-6-(3-methyl-2-buten-1-yl)- [ACD/Index Name]
5,7-Dihydroxy-8-(2-hydroxy-3-methyl-3-buten-1-yl)-3-(4-hydroxyphenyl)-6-(3-methyl-2-buten-1-yl)-4H-chromen-4-on [German] [ACD/IUPAC Name]
5,7-Dihydroxy-8-(2-hydroxy-3-methyl-3-buten-1-yl)-3-(4-hydroxyphenyl)-6-(3-methyl-2-buten-1-yl)-4H-chromen-4-one [ACD/IUPAC Name]
5,7-Dihydroxy-8-(2-hydroxy-3-méthyl-3-butén-1-yl)-3-(4-hydroxyphényl)-6-(3-méthyl-2-butén-1-yl)-4H-chromén-4-one [French] [ACD/IUPAC Name]
[154992-17-3] [RN]
154992-17-3 [RN]
5,7-dihydroxy-8-(2-hydroxy-3-methylbut-3-enyl)-3-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)chromen-4-one
Erysenegalensein E
ErysenegalenseinE
MFCD26406118

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

Density: 1.3±0.1 g/cm3
Boiling Point: 667.4±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: 228.7±25.0 °C
Index of Refraction: 1.643
Molar Refractivity: 117.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.51
ACD/LogD (pH 5.5): 4.89
ACD/BCF (pH 5.5): 3018.80
ACD/KOC (pH 5.5): 10680.57
ACD/LogD (pH 7.4): 4.33
ACD/BCF (pH 7.4): 840.04
ACD/KOC (pH 7.4): 2972.07
Polar Surface Area: 107 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 325.4±3.0 cm3

Click to predict properties on the Chemicalize site


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