Mixture of Formic acid + Diethyl fumarate + Water

Name: Formic acid
InChI: InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)
InChI Key: BDAGIHXWWSANSR-UHFFFAOYSA-N
Formula: CH2O2
SMILES: O=CO
Mol. Weight (g/mol): 46.03
CAS: 64-18-6

Name: Diethyl fumarate
InChI: InChI=1S/C8H12O4/c1-3-11-7(9)5-6-8(10)12-4-2/h5-6H,3-4H2,1-2H3/b6-5+
InChI Key: IEPRKVQEAMIZSS-AATRIKPKSA-N
Formula: C8H12O4
SMILES: CCOC(=O)C=CC(=O)OCC
Mol. Weight (g/mol): 172.18
CAS: 623-91-6

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 (6)

Mole fraction of Formic acid (1) [ref]

Operational conditions:

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

Mole fraction of Water (3) - Liquid mixture 1	Mole fraction of Formic acid (1) - Liquid mixture 1
0.0857	0.0000
0.1382	0.0604
0.2149	0.1262
0.2614	0.1759
0.3324	0.2365
0.4016	0.2948
0.4542	0.3435
0.4927	0.3782
0.5165	0.3843
0.5546	0.3952
0.5897	0.3831
0.6289	0.3577
0.6964	0.2995
0.7907	0.2074
0.8519	0.1466
0.9072	0.0916
0.9583	0.0412
0.9999	0.0000

Mole fraction of Diethyl fumarate (2) [ref]

Operational conditions:

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

Mole fraction of Water (3) - Liquid mixture 1	Mole fraction of Diethyl fumarate (2) - Liquid mixture 1
0.0857	0.9143
0.1382	0.8014
0.2149	0.6589
0.2614	0.5627
0.3324	0.4311
0.4016	0.3036
0.4542	0.2023
0.4927	0.1291
0.5165	0.0992
0.5546	0.0502
0.5897	0.0272
0.6289	0.0134
0.6964	0.0041
0.7907	0.0019
0.8519	0.0015
0.9072	0.0012
0.9583	0.0005
0.9999	0.0001

Mole fraction [ref]

Operational conditions:

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

Fixed	Measured
Mole fraction of Water (3) - Liquid mixture 2	Mole fraction of Formic acid (1) - Liquid mixture 2	Mole fraction of Formic acid (1) - Liquid mixture 1	Mole fraction of Water (3) - Liquid mixture 1
0.1329	0.0547	0.0397	0.9598
0.1630	0.0898	0.0657	0.9333
0.2214	0.1351	0.1072	0.8915
0.2816	0.1979	0.1587	0.8397
0.3356	0.2362	0.1859	0.8123

Mole fraction of Formic acid (1) [ref]

Operational conditions:

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

Mole fraction of Water (3) - Liquid mixture 1	Mole fraction of Formic acid (1) - Liquid mixture 1
0.0857	0.0000
0.1382	0.0604
0.2149	0.1262
0.2614	0.1759
0.3324	0.2365
0.4016	0.2948
0.4542	0.3435
0.4927	0.3782
0.5165	0.3843
0.5546	0.3952
0.5897	0.3831
0.6289	0.3577
0.6964	0.2995
0.7907	0.2074
0.8519	0.1466
0.9072	0.0916
0.9583	0.0412
0.9999	0.0000

Mole fraction of Diethyl fumarate (2) [ref]

Operational conditions:

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

Mole fraction of Water (3) - Liquid mixture 1	Mole fraction of Diethyl fumarate (2) - Liquid mixture 1
0.0857	0.9143
0.1382	0.8014
0.2149	0.6589
0.2614	0.5627
0.3324	0.4311
0.4016	0.3036
0.4542	0.2023
0.4927	0.1291
0.5165	0.0992
0.5546	0.0502
0.5897	0.0272
0.6289	0.0134
0.6964	0.0041
0.7907	0.0019
0.8519	0.0015
0.9072	0.0012
0.9583	0.0005
0.9999	0.0001

Mole fraction [ref]

Operational conditions:

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

Fixed	Measured
Mole fraction of Water (3) - Liquid mixture 2	Mole fraction of Formic acid (1) - Liquid mixture 2	Mole fraction of Formic acid (1) - Liquid mixture 1	Mole fraction of Water (3) - Liquid mixture 1
0.1329	0.0547	0.0397	0.9598
0.1630	0.0898	0.0657	0.9333
0.2214	0.1351	0.1072	0.8915
0.2816	0.1979	0.1587	0.8397
0.3356	0.2362	0.1859	0.8123

Sources

Liquid phase equilibria of (water + formic acid + diethyl carbonate or diethyl malonate or diethyl fumarate) ternary systems at 298.15K and atmospheric pressure