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Mixture of Furaneol + Ethyl Acetate
Name
Furaneol
InChI
InChI=1S/C6H8O3/c1-3-5(7)6(8)4(2)9-3/h3,8H,1-2H3
InChI Key
INAXVXBDKKUCGI-UHFFFAOYSA-N
Formula
C6H8O3
SMILES
CC1=C(O)C(=O)C(C)O1
Mol. Weight (g/mol)
128.13
CAS
3658-77-3
Name
Ethyl Acetate
InChI
InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
InChI Key
XEKOWRVHYACXOJ-UHFFFAOYSA-N
Formula
C4H8O2
SMILES
CCOC(C)=O
Mol. Weight (g/mol)
88.11
CAS
141-78-6
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Datasets
Mole fraction
Mole fraction of Furaneol (1)
[ref]
Operational condition: Pressure, kPa = 100 (Liquid)
Temperature, K - Liquid
Mole fraction of Furaneol (1) - Liquid
283.15
0.0829
288.15
0.1195
293.15
0.1452
298.15
0.1817
303.15
0.2235
308.15
0.2712
313.15
0.3196
318.15
0.3749
Sources
Thermodynamic equilibrium of 4-hydroxy-2,5-dimethyl-3(2H)-furanone in different solvent systems
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