ChemSpider 2D Image | 1,6-Dihydroxy-3,5-dimethoxy-2,4-bis(3-methyl-2-buten-1-yl)-9H-xanthen-9-one | C25H28O6

1,6-Dihydroxy-3,5-dimethoxy-2,4-bis(3-methyl-2-buten-1-yl)-9H-xanthen-9-one

  • Molecular FormulaC25H28O6
  • Average mass424.486 Da
  • Monoisotopic mass424.188599 Da
  • ChemSpider ID28533846

More details:

Featured data source
Natural Product Updates

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

1,6-Dihydroxy-3,5-dimethoxy-2,4-bis(3-methyl-2-buten-1-yl)-9H-xanthen-9-on [German] [ACD/IUPAC Name]
1,6-Dihydroxy-3,5-dimethoxy-2,4-bis(3-methyl-2-buten-1-yl)-9H-xanthen-9-one [ACD/IUPAC Name]
1,6-Dihydroxy-3,5-diméthoxy-2,4-bis(3-méthyl-2-butén-1-yl)-9H-xanthén-9-one [French] [ACD/IUPAC Name]
9H-Xanthen-9-one, 1,6-dihydroxy-3,5-dimethoxy-2,4-bis(3-methyl-2-buten-1-yl)- [ACD/Index Name]
doitunggarcinone C

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

Density: 1.2±0.1 g/cm3
Boiling Point: 616.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 208.3±25.0 °C
Index of Refraction: 1.598
Molar Refractivity: 119.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.67
ACD/LogD (pH 5.5): 5.40
ACD/BCF (pH 5.5): 7385.82
ACD/KOC (pH 5.5): 20152.39
ACD/LogD (pH 7.4): 4.56
ACD/BCF (pH 7.4): 1065.23
ACD/KOC (pH 7.4): 2906.52
Polar Surface Area: 85 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 48.3±3.0 dyne/cm
Molar Volume: 350.0±3.0 cm3

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