ChemSpider 2D Image | 7-Hydroxy-6-[(~13~C,~2~H_3_)methyloxy]-2H-chromen-2-one | C913CH5D3O4


  • Molecular FormulaC913CH5D3O4
  • Average mass196.179 Da
  • Monoisotopic mass196.064438 Da
  • ChemSpider ID77494371
  • Non-standard isotope - Non-standard isotope

More details:

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

2H-1-Benzopyran-2-one, 7-hydroxy-6-(methyl-13C-d3-oxy)- [ACD/Index Name]
7-Hydroxy-6-[(13C,2H3)methyloxy]-2H-chromen-2-on [German] [ACD/IUPAC Name]
7-Hydroxy-6-[(13C,2H3)methyloxy]-2H-chromen-2-one [ACD/IUPAC Name]
7-Hydroxy-6-[(13C,2H3)méthyloxy]-2H-chromén-2-one [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.609
Molar Refractivity: 48.3±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 19.2±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 139.5±3.0 cm3

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