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Mixture of n-Hexane + p-Xylene + Furfural

Name: n-Hexane
InChI: InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3
InChI Key: VLKZOEOYAKHREP-UHFFFAOYSA-N
Formula: C6H14
SMILES: CCCCCC
Mol. Weight (g/mol): 86.18
CAS: 110-54-3

Name: p-Xylene
InChI: InChI=1S/C8H10/c1-7-3-5-8(2)6-4-7/h3-6H,1-2H3
InChI Key: URLKBWYHVLBVBO-UHFFFAOYSA-N
Formula: C8H10
SMILES: Cc1ccc(C)cc1
Mol. Weight (g/mol): 106.17
CAS: 106-42-3

Name: Furfural
InChI: InChI=1S/C5H4O2/c6-4-5-2-1-3-7-5/h1-4H
InChI Key: HYBBIBNJHNGZAN-UHFFFAOYSA-N
Formula: C5H4O2
SMILES: O=Cc1ccco1
Mol. Weight (g/mol): 96.08
CAS: 98-01-1

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Datasets

Mole fraction (4)

Mole fraction of p-Xylene (2) [ref]

Operational conditions:

Temperature, K = 298.15 (Liquid mixture 1)
Pressure, kPa = 101.325 (Liquid mixture 1)

Mole fraction of Furfural (3) - Liquid mixture 1	Mole fraction of p-Xylene (2) - Liquid mixture 1
0.0460	0.0000
0.0560	0.0390
0.0680	0.0830
0.1160	0.2260
0.1630	0.2850
0.1930	0.3030
0.2380	0.3210
0.2760	0.3290
0.3490	0.3220
0.4260	0.2990
0.5140	0.2690
0.6100	0.2240
0.7310	0.1460
0.8830	0.0360
0.9330	0.0000

Mole fraction [ref]

Operational conditions:

Temperature, K = 298.15 (Liquid mixture 1)
Pressure, kPa = 101.325 (Liquid mixture 1)

Fixed	Measured
Mole fraction of Furfural (3) - Liquid mixture 1	Mole fraction of p-Xylene (2) - Liquid mixture 1	Mole fraction of p-Xylene (2) - Liquid mixture 2	Mole fraction of Furfural (3) - Liquid mixture 2
0.8730	0.0460	0.1560	0.0980
0.8140	0.0870	0.2550	0.1350
0.7570	0.1310	0.3050	0.1940
0.6750	0.1850	0.3290	0.2790
0.6100	0.2220	0.3170	0.3700

Mole fraction of p-Xylene (2) [ref]

Operational conditions:

Temperature, K = 298.15 (Liquid mixture 1)
Pressure, kPa = 101.325 (Liquid mixture 1)

Mole fraction of Furfural (3) - Liquid mixture 1	Mole fraction of p-Xylene (2) - Liquid mixture 1
0.0460	0.0000
0.0560	0.0390
0.0680	0.0830
0.1160	0.2260
0.1630	0.2850
0.1930	0.3030
0.2380	0.3210
0.2760	0.3290
0.3490	0.3220
0.4260	0.2990
0.5140	0.2690
0.6100	0.2240
0.7310	0.1460
0.8830	0.0360
0.9330	0.0000

Mole fraction [ref]

Operational conditions:

Temperature, K = 298.15 (Liquid mixture 1)
Pressure, kPa = 101.325 (Liquid mixture 1)

Fixed	Measured
Mole fraction of Furfural (3) - Liquid mixture 1	Mole fraction of p-Xylene (2) - Liquid mixture 1	Mole fraction of p-Xylene (2) - Liquid mixture 2	Mole fraction of Furfural (3) - Liquid mixture 2
0.8730	0.0460	0.1560	0.0980
0.8140	0.0870	0.2550	0.1350
0.7570	0.1310	0.3050	0.1940
0.6750	0.1850	0.3290	0.2790
0.6100	0.2220	0.3170	0.3700

Sources

Liquid-liquid equilibria for mixtures of (Furfural + an Aromatic hydrocarbon + an alkane) at T=298.15 K