Mixture of Carbonic acid, methyl phenyl ester + Diphenyl carbonate + Water

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Carbonic acid, methyl phenyl ester

Name
Carbonic acid, methyl phenyl ester
InChI
InChI=1S/C8H8O3/c1-10-8(9)11-7-5-3-2-4-6-7/h2-6H,1H3
InChI Key
XTBFPVLHGVYOQH-UHFFFAOYSA-N
Formula
C8H8O3
SMILES
COC(=O)Oc1ccccc1
Mol. Weight (g/mol)
152.15
CAS
13509-27-8

Diphenyl carbonate

Name
Diphenyl carbonate
InChI
InChI=1S/C13H10O3/c14-13(15-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h1-10H
InChI Key
ROORDVPLFPIABK-UHFFFAOYSA-N
Formula
C13H10O3
SMILES
O=C(Oc1ccccc1)Oc1ccccc1
Mol. Weight (g/mol)
214.22
CAS
102-09-0

Water

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

  1. Mole fraction (2)

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Diphenyl carbonate (2) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 2 Mole fraction of Diphenyl carbonate (2) - Liquid mixture 1 Mole fraction of Water (3) - Liquid mixture 1
0.0000 0.2341 0.0000 0.9990
0.7888 0.1392 0.0001 0.9995
0.8653 0.1347 0.0001 0.9999
0.0836 0.2031 0.0001 0.9995
0.1995 0.1695 0.0001 0.9994
0.3189 0.1495 0.0001 0.9995
0.4292 0.1349 0.0001 0.9994
0.5421 0.1319 0.0001 0.9997
0.6429 0.1311 0.0001 0.9995
0.7188 0.1299 0.0001 0.9995

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Diphenyl carbonate (2) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 2 Mole fraction of Diphenyl carbonate (2) - Liquid mixture 1 Mole fraction of Water (3) - Liquid mixture 1
0.0000 0.2341 0.0000 0.9990
0.7888 0.1392 0.0001 0.9995
0.8653 0.1347 0.0001 0.9999
0.0836 0.2031 0.0001 0.9995
0.1995 0.1695 0.0001 0.9994
0.3189 0.1495 0.0001 0.9995
0.4292 0.1349 0.0001 0.9994
0.5421 0.1319 0.0001 0.9997
0.6429 0.1311 0.0001 0.9995
0.7188 0.1299 0.0001 0.9995

Sources