Mixture of 1-Propanol + Acetic acid, methyl ester + Water

Excel

1-Propanol

Name
1-Propanol
InChI
InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3
InChI Key
BDERNNFJNOPAEC-UHFFFAOYSA-N
Formula
C3H8O
SMILES
CCCO
Mol. Weight (g/mol)
60.09
CAS
71-23-8

Acetic acid, methyl ester

Name
Acetic acid, methyl ester
InChI
InChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3
InChI Key
KXKVLQRXCPHEJC-UHFFFAOYSA-N
Formula
C3H6O2
SMILES
COC(C)=O
Mol. Weight (g/mol)
74.08
CAS
79-20-9

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 Water (3) - Liquid mixture 2 Mole fraction of 1-Propanol (1) - Liquid mixture 2 Mole fraction of 1-Propanol (1) - Liquid mixture 1 Mole fraction of Water (3) - Liquid mixture 1
0.5463 0.0498 0.0183 0.8813
0.4005 0.0425 0.0116 0.9051
0.6568 0.0500 0.0248 0.8507
0.2636 0.0000 0.0000 0.9300

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Water (3) - Liquid mixture 2 Mole fraction of 1-Propanol (1) - Liquid mixture 2 Mole fraction of 1-Propanol (1) - Liquid mixture 1 Mole fraction of Water (3) - Liquid mixture 1
0.5463 0.0498 0.0183 0.8813
0.4005 0.0425 0.0116 0.9051
0.6568 0.0500 0.0248 0.8507
0.2636 0.0000 0.0000 0.9300

Sources