Mixture of Isobutyl acetate + Phenol + Water

Excel

Isobutyl acetate

Name
Isobutyl acetate
InChI
InChI=1S/C6H12O2/c1-5(2)4-8-6(3)7/h5H,4H2,1-3H3
InChI Key
GJRQTCIYDGXPES-UHFFFAOYSA-N
Formula
C6H12O2
SMILES
CC(=O)OCC(C)C
Mol. Weight (g/mol)
116.16
CAS
110-19-0

Phenol

Name
Phenol
InChI
InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H
InChI Key
ISWSIDIOOBJBQZ-UHFFFAOYSA-N
Formula
C6H6O
SMILES
Oc1ccccc1
Mol. Weight (g/mol)
94.11
CAS
108-95-2

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
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Datasets

  1. Mass fraction (4)

Mass fraction of Phenol (2) [ref]

Operational conditions:

Mass fraction of Water (3) - Liquid mixture 1 Mass fraction of Phenol (2) - Liquid mixture 1
0.0212 0.0000
0.0243 0.0982
0.0313 0.1941
0.0398 0.2881
0.0467 0.3814
0.0549 0.4727
0.0714 0.5567
0.0995 0.6299
0.1366 0.6900
0.1938 0.7233
0.2941 0.7059
0.9914 0.0000
0.9771 0.0180
0.9656 0.0316
0.9526 0.0457
0.9386 0.0605
0.9225 0.0772
0.9173 0.0827

Mass fraction [ref]

Operational conditions:

Fixed Measured
Mass fraction of Phenol (2) - Liquid mixture 2 Mass fraction of Water (3) - Liquid mixture 2 Mass fraction of Phenol (2) - Liquid mixture 1 Mass fraction of Water (3) - Liquid mixture 1
0.1829 0.0330 0.0019 0.9910
0.3196 0.0400 0.0100 0.9838
0.4107 0.0477 0.0187 0.9759
0.4804 0.0576 0.0243 0.9709
0.5302 0.0679 0.0305 0.9653
0.5680 0.0754 0.0387 0.9580

Mass fraction of Phenol (2) [ref]

Operational conditions:

Mass fraction of Water (3) - Liquid mixture 1 Mass fraction of Phenol (2) - Liquid mixture 1
0.0212 0.0000
0.0243 0.0982
0.0313 0.1941
0.0398 0.2881
0.0467 0.3814
0.0549 0.4727
0.0714 0.5567
0.0995 0.6299
0.1366 0.6900
0.1938 0.7233
0.2941 0.7059
0.9914 0.0000
0.9771 0.0180
0.9656 0.0316
0.9526 0.0457
0.9386 0.0605
0.9225 0.0772
0.9173 0.0827

Mass fraction [ref]

Operational conditions:

Fixed Measured
Mass fraction of Phenol (2) - Liquid mixture 2 Mass fraction of Water (3) - Liquid mixture 2 Mass fraction of Phenol (2) - Liquid mixture 1 Mass fraction of Water (3) - Liquid mixture 1
0.1829 0.0330 0.0019 0.9910
0.3196 0.0400 0.0100 0.9838
0.4107 0.0477 0.0187 0.9759
0.4804 0.0576 0.0243 0.9709
0.5302 0.0679 0.0305 0.9653
0.5680 0.0754 0.0387 0.9580

Sources