ChemSpider 2D Image | 6-methoxycomaparvin | C18H18O6

6-methoxycomaparvin

  • Molecular FormulaC18H18O6
  • Average mass330.332 Da
  • Monoisotopic mass330.110352 Da
  • ChemSpider ID23314453

More details:

Featured data source
Natural Product Updates

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

4H-Naphtho[1,2-b]pyran-4-one, 5,8-dihydroxy-6,10-dimethoxy-2-propyl- [ACD/Index Name]
5,8-Dihydroxy-6,10-dimethoxy-2-propyl-4H-benzo[h]chromen-4-on [German] [ACD/IUPAC Name]
5,8-Dihydroxy-6,10-dimethoxy-2-propyl-4H-benzo[h]chromen-4-one [ACD/IUPAC Name]
5,8-Dihydroxy-6,10-diméthoxy-2-propyl-4H-benzo[h]chromén-4-one [French] [ACD/IUPAC Name]
6-methoxycomaparvin
111397-48-9 [RN]
5,8-Dihydroxy-6,10-dimethoxy-2-propyl-4H-naphtho[1,2-b]pyran-4-one
5,8-DIHYDROXY-6,10-DIMETHOXY-2-PROPYLBENZO[H]CHROMEN-4-ONE
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL401565/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 570.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 209.7±23.6 °C
Index of Refraction: 1.634
Molar Refractivity: 88.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 3.41
ACD/BCF (pH 5.5): 215.39
ACD/KOC (pH 5.5): 1514.78
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 11.60
ACD/KOC (pH 7.4): 81.58
Polar Surface Area: 85 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 248.1±3.0 cm3

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