Mixture of Butanedioic acid + Carbamazepine + Ethanol

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Butanedioic acid

Name
Butanedioic acid
InChI
InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)
InChI Key
KDYFGRWQOYBRFD-UHFFFAOYSA-N
Formula
C4H6O4
SMILES
O=C(O)CCC(=O)O
Mol. Weight (g/mol)
118.09
CAS
110-15-6

Carbamazepine

Name
Carbamazepine
InChI
InChI=1S/C15H12N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,16,18)
InChI Key
FFGPTBGBLSHEPO-UHFFFAOYSA-N
Formula
C15H12N2O
SMILES
NC(=O)N1c2ccccc2C=Cc2ccccc21
Mol. Weight (g/mol)
236.27
CAS
298-46-4

Ethanol

Name
Ethanol
InChI
InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
InChI Key
LFQSCWFLJHTTHZ-UHFFFAOYSA-N
Formula
C2H6O
SMILES
CCO
Mol. Weight (g/mol)
46.07
CAS
64-17-5
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Datasets

  1. Mole fraction (14)

Mole fraction of Butanedioic acid (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Butanedioic acid (1) - Liquid
298.15 0.0809
308.15 0.1033

Mole fraction of Butanedioic acid (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Butanedioic acid (1) - Liquid
298.15 0.0034
308.15 0.0043

Mole fraction of Carbamazepine (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Carbamazepine (2) - Liquid
298.15 0.0028
308.15 0.0039

Mole fraction of Carbamazepine (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Carbamazepine (2) - Liquid
298.15 0.0295
308.15 0.0464

Mole fraction of Butanedioic acid (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Mole fraction of Carbamazepine (2) - Liquid Mole fraction of Butanedioic acid (1) - Liquid
298.15 0.0824 0.0022
298.15 0.0858 0.0009
298.15 0.0884 0.0000
308.15 0.1091 0.0020
308.15 0.1140 0.0005
308.15 0.1156 0.0000

Mole fraction of Butanedioic acid (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Mole fraction of Carbamazepine (2) - Liquid Mole fraction of Butanedioic acid (1) - Liquid
298.15 0.0000 0.0307
298.15 0.0006 0.0305
298.15 0.0017 0.0301
298.15 0.0028 0.0298
308.15 0.0000 0.0486
308.15 0.0009 0.0482
308.15 0.0023 0.0474
308.15 0.0037 0.0467

Mole fraction of Butanedioic acid (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Mole fraction of Carbamazepine (2) - Liquid Mole fraction of Butanedioic acid (1) - Liquid
298.15 0.0050 0.0085
298.15 0.0599 0.0030
308.15 0.0164 0.0116
308.15 0.0752 0.0032

Mole fraction of Butanedioic acid (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Butanedioic acid (1) - Liquid
298.15 0.0809
308.15 0.1033

Mole fraction of Butanedioic acid (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Butanedioic acid (1) - Liquid
298.15 0.0034
308.15 0.0043

Mole fraction of Carbamazepine (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Carbamazepine (2) - Liquid
298.15 0.0028
308.15 0.0039

Mole fraction of Carbamazepine (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Carbamazepine (2) - Liquid
298.15 0.0295
308.15 0.0464

Mole fraction of Butanedioic acid (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Mole fraction of Carbamazepine (2) - Liquid Mole fraction of Butanedioic acid (1) - Liquid
298.15 0.0824 0.0022
298.15 0.0858 0.0009
298.15 0.0884 0.0000
308.15 0.1091 0.0020
308.15 0.1140 0.0005
308.15 0.1156 0.0000

Mole fraction of Butanedioic acid (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Mole fraction of Carbamazepine (2) - Liquid Mole fraction of Butanedioic acid (1) - Liquid
298.15 0.0000 0.0307
298.15 0.0006 0.0305
298.15 0.0017 0.0301
298.15 0.0028 0.0298
308.15 0.0000 0.0486
308.15 0.0009 0.0482
308.15 0.0023 0.0474
308.15 0.0037 0.0467

Mole fraction of Butanedioic acid (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Mole fraction of Carbamazepine (2) - Liquid Mole fraction of Butanedioic acid (1) - Liquid
298.15 0.0050 0.0085
298.15 0.0599 0.0030
308.15 0.0164 0.0116
308.15 0.0752 0.0032

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