Found 10 results

Search term: INAXVXBDKKUCGI (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4-Hydroxy-5-methyl-2-(~2~H_3_)methyl-3(2H)-furanone | C6H5D3O3

4-Hydroxy-5-methyl-2-(2H3)methyl-3(2H)-furanone

  • Molecular FormulaC6H5D3O3
  • Average mass131.144 Da
  • Monoisotopic mass131.066177 Da
  • ChemSpider ID128917852

  • Non-standard isotope - Non-standard isotope

More details:

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

3(2H)-Furanone, 4-hydroxy-5-methyl-2-(methyl-d3)- [ACD/Index Name]
4-Hydroxy-5-methyl-2-(2H3)methyl-3(2H)-furanon [German] [ACD/IUPAC Name]
4-Hydroxy-5-methyl-2-(2H3)methyl-3(2H)-furanone [ACD/IUPAC Name]
4-Hydroxy-5-méthyl-2-(2H3)méthyl-3(2H)-furanone [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 215.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 52.6±6.0 kJ/mol
Flash Point: 90.5±20.8 °C
Index of Refraction: 1.513
Molar Refractivity: 30.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.34
ACD/LogD (pH 5.5): 0.41
ACD/BCF (pH 5.5): 1.20
ACD/KOC (pH 5.5): 39.74
ACD/LogD (pH 7.4): 0.41
ACD/BCF (pH 7.4): 1.20
ACD/KOC (pH 7.4): 39.51
Polar Surface Area: 47 Å2
Polarizability: 12.2±0.5 10-24cm3
Surface Tension: 42.2±3.0 dyne/cm
Molar Volume: 102.5±3.0 cm3

Click to predict properties on the Chemicalize site


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