ChemSpider 2D Image | 6-Hydroxy-8-methoxy-1-methyl-1,2-dihydrocyclopenta[c]isochromene-3,5-dione | C14H12O5

6-Hydroxy-8-methoxy-1-methyl-1,2-dihydrocyclopenta[c]isochromene-3,5-dione

  • Molecular FormulaC14H12O5
  • Average mass260.242 Da
  • Monoisotopic mass260.068481 Da
  • ChemSpider ID23318842

More details:

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

6-Hydroxy-8-methoxy-1-methyl-1,2-dihydrocyclopenta[c]isochromen-3,5-dion [German] [ACD/IUPAC Name]
6-Hydroxy-8-methoxy-1-methyl-1,2-dihydrocyclopenta[c]isochromene-3,5-dione [ACD/IUPAC Name]
6-Hydroxy-8-méthoxy-1-méthyl-1,2-dihydrocyclopenta[c]isochromène-3,5-dione [French] [ACD/IUPAC Name]
Benzo[d]cyclopenta[b]pyran-3,5-dione, 1,2-dihydro-6-hydroxy-8-methoxy-1-methyl- [ACD/Index Name]
1-deoxyrubralactone
6-hydroxy-8-methoxy-1-methyl-1,2,3a, 9b--tetrahydrocyclopenta[c]isochromene-3,5-dione
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL260980/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 509.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.9±3.0 kJ/mol
Flash Point: 199.6±23.6 °C
Index of Refraction: 1.633
Molar Refractivity: 64.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.90
ACD/LogD (pH 5.5): 2.81
ACD/BCF (pH 5.5): 79.21
ACD/KOC (pH 5.5): 780.93
ACD/LogD (pH 7.4): 2.03
ACD/BCF (pH 7.4): 13.24
ACD/KOC (pH 7.4): 130.50
Polar Surface Area: 73 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 62.2±5.0 dyne/cm
Molar Volume: 180.1±5.0 cm3

Click to predict properties on the Chemicalize site


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