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Search term: ARMDEJAJCWGZTE (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylic acid | C20H16O7

3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylic acid

  • Molecular FormulaC20H16O7
  • Average mass368.337 Da
  • Monoisotopic mass368.089600 Da
  • ChemSpider ID21834960

More details:

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

3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromen-2-carbonsäure [German] [ACD/IUPAC Name]
3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylic acid [ACD/IUPAC Name]
4H-1-Benzopyran-2-carboxylic acid, 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-4-oxo- [ACD/Index Name]
Acide 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-éthyl-7-hydroxy-4-oxo-4H-chromène-2-carboxylique [French] [ACD/IUPAC Name]
1007652-10-9 [RN]
3-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylic acid
3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylic acid
3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 576.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 208.7±23.6 °C
Index of Refraction: 1.663
Molar Refractivity: 92.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.79
ACD/LogD (pH 5.5): -0.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 67.5±3.0 dyne/cm
Molar Volume: 249.7±3.0 cm3

Click to predict properties on the Chemicalize site


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