Mixture of claritine + Ethyl Acetate

claritine

Name
claritine
InChI
InChI=1S/C22H23ClN2O2/c1-2-27-22(26)25-12-9-15(10-13-25)20-19-8-7-18(23)14-17(19)6-5-16-4-3-11-24-21(16)20/h3-4,7-8,11,14H,2,5-6,9-10,12-13H2,1H3
InChI Key
JCCNYMKQOSZNPW-UHFFFAOYSA-N
Formula
C22H23ClN2O2
SMILES
CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1
Mol. Weight (g/mol)
382.89

Ethyl Acetate

Name
Ethyl Acetate
InChI
InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
InChI Key
XEKOWRVHYACXOJ-UHFFFAOYSA-N
Formula
C4H8O2
SMILES
CCOC(C)=O
Mol. Weight (g/mol)
88.11
CAS
141-78-6
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Datasets

  1. Mole fraction

Mole fraction of claritine (1) [ref]

Operational condition: Pressure, kPa = 100 (Liquid)

Temperature, K - Liquid Mole fraction of claritine (1) - Liquid
283.15 0.0175
288.15 0.0208
293.15 0.0246
298.15 0.0293
303.12 0.0356
308.15 0.0430
313.15 0.0523
318.15 0.0634
323.20 0.0770

Sources