ChemSpider 2D Image | rhodomyrtone | C26H34O6

rhodomyrtone

  • Molecular FormulaC26H34O6
  • Average mass442.545 Da
  • Monoisotopic mass442.235535 Da
  • ChemSpider ID22370366

More details:

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

1H-Xanthene-1,3(2H)-dione, 4,9-dihydro-6,8-dihydroxy-2,2,4,4-tetramethyl-7-(3-methyl-1-oxobutyl)-9-(2-methylpropyl)- [ACD/Index Name]
6,8-Dihydroxy-9-isobutyl-2,2,4,4-tetramethyl-7-(3-methylbutanoyl)-4,9-dihydro-1H-xanthen-1,3(2H)-dion [German] [ACD/IUPAC Name]
6,8-Dihydroxy-9-isobutyl-2,2,4,4-tetramethyl-7-(3-methylbutanoyl)-4,9-dihydro-1H-xanthene-1,3(2H)-dione [ACD/IUPAC Name]
6,8-Dihydroxy-9-isobutyl-2,2,4,4-tétraméthyl-7-(3-méthylbutanoyl)-4,9-dihydro-1H-xanthène-1,3(2H)-dione [French] [ACD/IUPAC Name]
rhodomyrtone

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

Density: 1.2±0.1 g/cm3
Boiling Point: 533.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.0±3.0 kJ/mol
Flash Point: 170.6±23.6 °C
Index of Refraction: 1.572
Molar Refractivity: 119.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.70
ACD/LogD (pH 5.5): 6.45
ACD/BCF (pH 5.5): 45765.60
ACD/KOC (pH 5.5): 72738.44
ACD/LogD (pH 7.4): 5.34
ACD/BCF (pH 7.4): 3504.79
ACD/KOC (pH 7.4): 5570.40
Polar Surface Area: 101 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 51.5±5.0 dyne/cm
Molar Volume: 364.0±5.0 cm3

Click to predict properties on the Chemicalize site


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