Mixture of n-Hexane + Toluene + 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: Toluene
InChI: InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3
InChI Key: YXFVVABEGXRONW-UHFFFAOYSA-N
Formula: C7H8
SMILES: Cc1ccccc1
Mol. Weight (g/mol): 92.14
CAS: 108-88-3

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 Toluene (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 Toluene (2) - Liquid mixture 1
0.0460	0.0000
0.0570	0.0440
0.0850	0.1280
0.1190	0.2180
0.2010	0.2990
0.2930	0.3200
0.3830	0.3110
0.4860	0.2890
0.6050	0.2400
0.7350	0.1600
0.8550	0.0650
0.9330	0.0000

Mole fraction [ref]

Operational conditions:

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

Fixed	Measured
Mole fraction of Furfural (3) - Liquid mixture 1	Mole fraction of Toluene (2) - Liquid mixture 1	Mole fraction of Toluene (2) - Liquid mixture 2	Mole fraction of Furfural (3) - Liquid mixture 2
0.8040	0.1110	0.1420	0.0900
0.7200	0.1720	0.2400	0.1400
0.6420	0.2190	0.2920	0.1920
0.5620	0.2570	0.3150	0.2660

Mole fraction of Toluene (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 Toluene (2) - Liquid mixture 1
0.0460	0.0000
0.0570	0.0440
0.0850	0.1280
0.1190	0.2180
0.2010	0.2990
0.2930	0.3200
0.3830	0.3110
0.4860	0.2890
0.6050	0.2400
0.7350	0.1600
0.8550	0.0650
0.9330	0.0000

Mole fraction [ref]

Operational conditions:

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

Fixed	Measured
Mole fraction of Furfural (3) - Liquid mixture 1	Mole fraction of Toluene (2) - Liquid mixture 1	Mole fraction of Toluene (2) - Liquid mixture 2	Mole fraction of Furfural (3) - Liquid mixture 2
0.8040	0.1110	0.1420	0.0900
0.7200	0.1720	0.2400	0.1400
0.6420	0.2190	0.2920	0.1920
0.5620	0.2570	0.3150	0.2660

Sources

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