ChemSpider 2D Image | 3-Isopropoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromene-6-carboxylate | C20H17O6

3-Isopropoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromene-6-carboxylate

  • Molecular FormulaC20H17O6
  • Average mass353.346 Da
  • Monoisotopic mass353.103058 Da
  • ChemSpider ID95707924

  • Charge - Charge

More details:

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

3-Isopropoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-6-carboxylat [German] [ACD/IUPAC Name]
3-Isopropoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromene-6-carboxylate [ACD/IUPAC Name]
3-Isopropoxy-2-(4-méthoxyphényl)-4-oxo-4H-chromène-6-carboxylate [French] [ACD/IUPAC Name]
4H-1-Benzopyran-6-carboxylic acid, 2-(4-methoxyphenyl)-3-(1-methylethoxy)-4-oxo-, ion(1-) [ACD/Index Name]

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

Density:
Boiling Point: 556.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 199.4±23.6 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.59
ACD/LogD (pH 5.5): 1.64
ACD/BCF (pH 5.5): 3.88
ACD/KOC (pH 5.5): 28.47
ACD/LogD (pH 7.4): 0.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.59
Polar Surface Area: 85 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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