ChemSpider 2D Image | 1,4,6-Trihydroxy-5-methoxy-7-(3-methyl-2-buten-1-yl)-9H-xanthen-9-one | C19H18O6

1,4,6-Trihydroxy-5-methoxy-7-(3-methyl-2-buten-1-yl)-9H-xanthen-9-one

  • Molecular FormulaC19H18O6
  • Average mass342.343 Da
  • Monoisotopic mass342.110352 Da
  • ChemSpider ID28424480

More details:






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

1,4,6-Trihydroxy-5-methoxy-7-(3-methyl-2-buten-1-yl)-9H-xanthen-9-on [German] [ACD/IUPAC Name]
1,4,6-Trihydroxy-5-methoxy-7-(3-methyl-2-buten-1-yl)-9H-xanthen-9-one [ACD/IUPAC Name]
1,4,6-Trihydroxy-5-méthoxy-7-(3-méthyl-2-butén-1-yl)-9H-xanthén-9-one [French] [ACD/IUPAC Name]
9H-Xanthen-9-one, 1,4,6-trihydroxy-5-methoxy-7-(3-methyl-2-buten-1-yl)- [ACD/Index Name]
[160623-47-2]
1,4,6-Trihydroxy-5-methoxy-7-(3-methylbut-2-en-1-yl)-9H-xanthen-9-one
1,4,6-trihydroxy-5-methoxy-7-(3-methylbut-2-en-1-yl)xanthen-9-one
1,4,6-Trihydroxy-5-methoxy-7-prenylxanthone
160623-47-2 [RN]
MFCD20260728

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 579.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.9±3.0 kJ/mol
Flash Point: 211.2±23.6 °C
Index of Refraction: 1.655
Molar Refractivity: 91.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.50
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 278.38
ACD/KOC (pH 5.5): 1947.00
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 108.14
ACD/KOC (pH 7.4): 756.32
Polar Surface Area: 96 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 61.6±3.0 dyne/cm
Molar Volume: 248.7±3.0 cm3

Click to predict properties on the Chemicalize site






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