Mixture of Benzene + Furfural + Hexadecane

Name: Benzene
InChI: InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H
InChI Key: UHOVQNZJYSORNB-UHFFFAOYSA-N
Formula: C6H6
SMILES: c1ccccc1
Mol. Weight (g/mol): 78.11
CAS: 71-43-2

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

Name: Hexadecane
InChI: InChI=1S/C16H34/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3-16H2,1-2H3
InChI Key: DCAYPVUWAIABOU-UHFFFAOYSA-N
Formula: C16H34
SMILES: CCCCCCCCCCCCCCCC
Mol. Weight (g/mol): 226.44
CAS: 544-76-3

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Datasets

Mole fraction (4)

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 (2) - Liquid mixture 2	Mole fraction of Benzene (1) - Liquid mixture 2	Mole fraction of Benzene (1) - Liquid mixture 1	Mole fraction of Furfural (2) - Liquid mixture 1
0.0770	0.4460	0.3150	0.6670
0.0930	0.4930	0.3560	0.6210
0.1240	0.5410	0.4060	0.5650
0.1810	0.5800	0.4750	0.4800
0.2350	0.5850	0.5190	0.4110

Mole fraction of Benzene (1) [ref]

Operational conditions:

Temperature, K = 298.15 (Liquid mixture 1)
Pressure, kPa = 101.3 (Liquid mixture 1)

Mole fraction of Furfural (2) - Liquid mixture 1	Mole fraction of Benzene (1) - Liquid mixture 1
0.0250	0.0000
0.0290	0.1630
0.0410	0.3170
0.0670	0.4230
0.1230	0.5420
0.1610	0.5670
0.2030	0.5820
0.2470	0.5830
0.2980	0.5690
0.3650	0.5460
0.4560	0.4920
0.6130	0.3660
0.7840	0.2030
0.9920	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 (2) - Liquid mixture 2	Mole fraction of Benzene (1) - Liquid mixture 2	Mole fraction of Benzene (1) - Liquid mixture 1	Mole fraction of Furfural (2) - Liquid mixture 1
0.0770	0.4460	0.3150	0.6670
0.0930	0.4930	0.3560	0.6210
0.1240	0.5410	0.4060	0.5650
0.1810	0.5800	0.4750	0.4800
0.2350	0.5850	0.5190	0.4110

Mole fraction of Benzene (1) [ref]

Operational conditions:

Temperature, K = 298.15 (Liquid mixture 1)
Pressure, kPa = 101.3 (Liquid mixture 1)

Mole fraction of Furfural (2) - Liquid mixture 1	Mole fraction of Benzene (1) - Liquid mixture 1
0.0250	0.0000
0.0290	0.1630
0.0410	0.3170
0.0670	0.4230
0.1230	0.5420
0.1610	0.5670
0.2030	0.5820
0.2470	0.5830
0.2980	0.5690
0.3650	0.5460
0.4560	0.4920
0.6130	0.3660
0.7840	0.2030
0.9920	0.0000

Sources

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