Mixture of Acetonitrile + Captopril

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Acetonitrile

Name
Acetonitrile
InChI
InChI=1S/C2H3N/c1-2-3/h1H3
InChI Key
WEVYAHXRMPXWCK-UHFFFAOYSA-N
Formula
C2H3N
SMILES
CC#N
Mol. Weight (g/mol)
41.05
CAS
75-05-8

Captopril

Name
Captopril
InChI
InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7+/m0/s1
InChI Key
FAKRSMQSSFJEIM-NKWVEPMBSA-N
Formula
C9H15NO3S
SMILES
CC(CS)C(=O)N1CCCC1C(=O)O
Mol. Weight (g/mol)
217.28
CAS
62571-86-2
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Datasets

  1. Mole fraction (2)

Mole fraction of Captopril (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Captopril (2) - Liquid
278.15 0.0097
283.15 0.0131
288.15 0.0181
293.15 0.0245
298.15 0.0322
303.15 0.0438
308.15 0.0606
313.15 0.0835

Mole fraction of Captopril (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Captopril (2) - Liquid
278.15 0.0097
283.15 0.0131
288.15 0.0181
293.15 0.0245
298.15 0.0322
303.15 0.0438
308.15 0.0606
313.15 0.0835

Sources