Mixture of nitrofurantoin + Acetic acid

nitrofurantoin

Name
nitrofurantoin
InChI
InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)
InChI Key
GSDSWSVVBLHKDQ-UHFFFAOYSA-N
Formula
C18H20FN3O4
SMILES
CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
Mol. Weight (g/mol)
361.37

Acetic acid

Name
Acetic acid
InChI
InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)
InChI Key
QTBSBXVTEAMEQO-UHFFFAOYSA-N
Formula
C2H4O2
SMILES
CC(=O)O
Mol. Weight (g/mol)
60.05
CAS
64-19-7
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Datasets

  1. Mole fraction

Mole fraction of nitrofurantoin (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of nitrofurantoin (1) - Liquid
298.15 0.0559
303.15 0.0579
308.15 0.0603
313.15 0.0626
318.15 0.0650
323.15 0.0672
328.15 0.0689

Sources