Mixture of 1-Undecanol + Propanoic acid + Water

Name: 1-Undecanol
InChI: InChI=1S/C11H24O/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,2-11H2,1H3
InChI Key: KJIOQYGWTQBHNH-UHFFFAOYSA-N
Formula: C11H24O
SMILES: CCCCCCCCCCCO
Mol. Weight (g/mol): 172.31
CAS: 112-42-5

Name: Propanoic acid
InChI: InChI=1S/C3H6O2/c1-2-3(4)5/h2H2,1H3,(H,4,5)
InChI Key: XBDQKXXYIPTUBI-UHFFFAOYSA-N
Formula: C3H6O2
SMILES: CCC(=O)O
Mol. Weight (g/mol): 74.08
CAS: 79-09-4

Name: Water
InChI: InChI=1S/H2O/h1H2
InChI Key: XLYOFNOQVPJJNP-UHFFFAOYSA-N
Formula: H2O
SMILES: O
Mol. Weight (g/mol): 18.02
CAS: 7732-18-5

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Datasets

Mole fraction (4)

Mole fraction [ref]

Operational conditions:

Pressure, kPa = 101 (Liquid mixture 2)
Temperature, K = 298.15 (Liquid mixture 2)

Fixed	Measured
Mole fraction of 1-Undecanol (1) - Liquid mixture 2	Mole fraction of Propanoic acid (2) - Liquid mixture 2	Mole fraction of 1-Undecanol (1) - Liquid mixture 1	Mole fraction of Propanoic acid (2) - Liquid mixture 1
0.6340	0.1040	0.0004	0.0108
0.5141	0.1872	0.0008	0.0241
0.3995	0.2578	0.0013	0.0391
0.2952	0.3035	0.0019	0.0586
0.2261	0.3238	0.0039	0.0894
0.1543	0.3275	0.0073	0.1208
0.1118	0.3170	0.0110	0.1473

Mole fraction of 1-Undecanol (1) [ref]

Operational conditions:

Pressure, kPa = 101 (Liquid mixture 1)
Temperature, K = 298.15 (Liquid mixture 1)

Mole fraction of Propanoic acid (2) - Liquid mixture 1	Mole fraction of 1-Undecanol (1) - Liquid mixture 1
0.0000	0.0001
0.0001	0.7733
0.0151	0.0006
0.0413	0.0013
0.0807	0.0033
0.1121	0.6123
0.1193	0.0070
0.1837	0.0181
0.2080	0.0253
0.2224	0.0308
0.2293	0.4419
0.2687	0.0552
0.2959	0.3067
0.2963	0.0831
0.3269	0.1365
0.3291	0.2128

Mole fraction [ref]

Operational conditions:

Pressure, kPa = 101 (Liquid mixture 2)
Temperature, K = 298.15 (Liquid mixture 2)

Fixed	Measured
Mole fraction of 1-Undecanol (1) - Liquid mixture 2	Mole fraction of Propanoic acid (2) - Liquid mixture 2	Mole fraction of 1-Undecanol (1) - Liquid mixture 1	Mole fraction of Propanoic acid (2) - Liquid mixture 1
0.6340	0.1040	0.0004	0.0108
0.5141	0.1872	0.0008	0.0241
0.3995	0.2578	0.0013	0.0391
0.2952	0.3035	0.0019	0.0586
0.2261	0.3238	0.0039	0.0894
0.1543	0.3275	0.0073	0.1208
0.1118	0.3170	0.0110	0.1473

Mole fraction of 1-Undecanol (1) [ref]

Operational conditions:

Pressure, kPa = 101 (Liquid mixture 1)
Temperature, K = 298.15 (Liquid mixture 1)

Mole fraction of Propanoic acid (2) - Liquid mixture 1	Mole fraction of 1-Undecanol (1) - Liquid mixture 1
0.0000	0.0001
0.0001	0.7733
0.0151	0.0006
0.0413	0.0013
0.0807	0.0033
0.1121	0.6123
0.1193	0.0070
0.1837	0.0181
0.2080	0.0253
0.2224	0.0308
0.2293	0.4419
0.2687	0.0552
0.2959	0.3067
0.2963	0.0831
0.3269	0.1365
0.3291	0.2128

Sources

Ternary liquid-liquid phase equilibria of (water-carboxylic acid-1-undecanol) systems at 298.15 K