Mixture of flubendazole + 2-Pyrrolidinone, 1-methyl-

flubendazole

Name
flubendazole
InChI
InChI=1S/C16H12FN3O3/c1-23-16(22)20-15-18-12-7-4-10(8-13(12)19-15)14(21)9-2-5-11(17)6-3-9/h2-8H,1H3,(H2,18,19,20,22)
InChI Key
CPEUVMUXAHMANV-UHFFFAOYSA-N
Formula
C16H12FN3O3
SMILES
COC(=O)Nc1nc2ccc(C(=O)c3ccc(F)cc3)cc2[nH]1
Mol. Weight (g/mol)
313.29

2-Pyrrolidinone, 1-methyl-

Name
2-Pyrrolidinone, 1-methyl-
InChI
InChI=1S/C5H9NO/c1-6-4-2-3-5(6)7/h2-4H2,1H3
InChI Key
SECXISVLQFMRJM-UHFFFAOYSA-N
Formula
C5H9NO
SMILES
CN1CCCC1=O
Mol. Weight (g/mol)
99.13
CAS
872-50-4
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Datasets

  1. Mole fraction

Mole fraction of flubendazole (1) [ref]

Operational condition: Pressure, kPa = 101.2 (Liquid)

Temperature, K - Liquid Mole fraction of flubendazole (1) - Liquid
283.15 0.0008
288.15 0.0009
293.15 0.0010
298.15 0.0012
303.15 0.0014
308.15 0.0016
313.15 0.0019
318.15 0.0022
323.15 0.0025
328.15 0.0031
333.15 0.0037

Sources