Mixture of 2,6-LUTIDINE 1-OXIDE + Pyridine, 2,6-dimethyl- + Water

Name: 2,6-LUTIDINE 1-OXIDE
InChI: InChI=1S/C7H9NO/c1-6-4-3-5-7(2)8(6)9/h3-5H,1-2H3
InChI Key: LIDGFHXPUOJZMK-UHFFFAOYSA-N
Formula: C7H9NO
SMILES: Cc1cccc(C)[n+]1[O-]
Mol. Weight (g/mol): 123.15

Name: Pyridine, 2,6-dimethyl-
InChI: InChI=1S/C7H9N/c1-6-4-3-5-7(2)8-6/h3-5H,1-2H3
InChI Key: OISVCGZHLKNMSJ-UHFFFAOYSA-N
Formula: C7H9N
SMILES: Cc1cccc(C)n1
Mol. Weight (g/mol): 107.16
CAS: 108-48-5

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

Mass fraction (2)

Mass fraction of 2,6-LUTIDINE 1-OXIDE (1) [ref]

Operational conditions:

Temperature, K = 383.15 (Liquid mixture 1)
Pressure, kPa = 100 (Liquid mixture 1)

Mass fraction of Pyridine, 2,6-dimethyl- (2) - Liquid mixture 1	Mass fraction of 2,6-LUTIDINE 1-OXIDE (1) - Liquid mixture 1
0.6707	0.0748
0.4962	0.1247
0.6416	0.0733
0.5740	0.1020
0.4880	0.1213
0.3995	0.1345

Mass fraction of 2,6-LUTIDINE 1-OXIDE (1) [ref]

Operational conditions:

Temperature, K = 383.15 (Liquid mixture 1)
Pressure, kPa = 100 (Liquid mixture 1)

Mass fraction of Pyridine, 2,6-dimethyl- (2) - Liquid mixture 1	Mass fraction of 2,6-LUTIDINE 1-OXIDE (1) - Liquid mixture 1
0.6707	0.0748
0.4962	0.1247
0.6416	0.0733
0.5740	0.1020
0.4880	0.1213
0.3995	0.1345

Sources

Toward an inherently safer alternative for operating N-oxidation of alkylpyridines: Effect of N-oxide on lutidine - water phase separation

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