ChemSpider 2D Image | 1-Hydroxy-2-(2-hydroxy-3-methyl-3-buten-1-yl)-3,6,7-trimethoxy-8-(3-methyl-2-buten-1-yl)-9H-xanthen-9-one | C26H30O7

1-Hydroxy-2-(2-hydroxy-3-methyl-3-buten-1-yl)-3,6,7-trimethoxy-8-(3-methyl-2-buten-1-yl)-9H-xanthen-9-one

  • Molecular FormulaC26H30O7
  • Average mass454.512 Da
  • Monoisotopic mass454.199158 Da
  • ChemSpider ID35014898

More details:

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

1-Hydroxy-2-(2-hydroxy-3-methyl-3-buten-1-yl)-3,6,7-trimethoxy-8-(3-methyl-2-buten-1-yl)-9H-xanthen-9-on [German] [ACD/IUPAC Name]
1-Hydroxy-2-(2-hydroxy-3-methyl-3-buten-1-yl)-3,6,7-trimethoxy-8-(3-methyl-2-buten-1-yl)-9H-xanthen-9-one [ACD/IUPAC Name]
1-Hydroxy-2-(2-hydroxy-3-méthyl-3-butén-1-yl)-3,6,7-triméthoxy-8-(3-méthyl-2-butén-1-yl)-9H-xanthén-9-one [French] [ACD/IUPAC Name]
9H-Xanthen-9-one, 1-hydroxy-2-(2-hydroxy-3-methyl-3-buten-1-yl)-3,6,7-trimethoxy-8-(3-methyl-2-buten-1-yl)- [ACD/Index Name]
1-hydroxy-2-(2-hydroxy-3-methylbut-3-en-1-yl)-3,6,7-trimethoxy-8-(3-methylbut-2-en-1-yl)-9H-xanthen-9-one
1-hydroxy-2-(2-hydroxy-3-methylbut-3-en-1-yl)-3,6,7-trimethoxy-8-(3-methylbut-2-en-1-yl)xanthen-9-one
1-Hydroxy-3,6,7-trimethoxy-2-(2-hydroxy-3-methyl-3-butenyl)-8-(3-methyl-2-butenyl)-xanthone

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

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

Density: 1.2±0.1 g/cm3
Boiling Point: 636.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.9±3.0 kJ/mol
Flash Point: 212.2±25.0 °C
Index of Refraction: 1.583
Molar Refractivity: 125.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.98
ACD/LogD (pH 5.5): 4.59
ACD/BCF (pH 5.5): 1767.13
ACD/KOC (pH 5.5): 7170.31
ACD/LogD (pH 7.4): 3.72
ACD/BCF (pH 7.4): 240.82
ACD/KOC (pH 7.4): 977.15
Polar Surface Area: 94 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 374.9±3.0 cm3

Click to predict properties on the Chemicalize site


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