Mixture of 3-nitrophthalonitrile + 1,2-Ethanediol

Name: 3-nitrophthalonitrile
InChI: InChI=1S/C8H3N3O2/c9-4-6-2-1-3-8(11(12)13)7(6)5-10/h1-3H
InChI Key: UZJZIZFCQFZDHP-UHFFFAOYSA-N
Formula: C8H3N3O2
SMILES: N#Cc1cccc([N+](=O)[O-])c1C#N
Mol. Weight (g/mol): 173.13

Name: 1,2-Ethanediol
InChI: InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI Key: LYCAIKOWRPUZTN-UHFFFAOYSA-N
Formula: C2H6O2
SMILES: OCCO
Mol. Weight (g/mol): 62.07
CAS: 107-21-1

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Datasets

Mole fraction (2)

Mole fraction of 3-nitrophthalonitrile (1) [ref]

Operational condition: Pressure, kPa = 101.2 (Liquid)

Temperature, K - Liquid	Mole fraction of 3-nitrophthalonitrile (1) - Liquid
278.15	0.0131
283.15	0.0158
288.15	0.0190
293.15	0.0226
298.15	0.0268
303.15	0.0317
308.15	0.0373
313.15	0.0438
318.15	0.0512
323.15	0.0596

Mole fraction of 3-nitrophthalonitrile (1) [ref]

Operational condition: Pressure, kPa = 101.2 (Liquid)

Temperature, K - Liquid	Mole fraction of 3-nitrophthalonitrile (1) - Liquid
278.15	0.0131
283.15	0.0158
288.15	0.0190
293.15	0.0226
298.15	0.0268
303.15	0.0317
308.15	0.0373
313.15	0.0438
318.15	0.0512
323.15	0.0596

Sources

Solubility and Solution Thermodynamics of 3-Nitrophthalonitrile in 12 Neat Solvents at Temperatures from 278.15 to 323.15 K

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