Mixture of 2-Hexanone + Phenol + Water

Excel

2-Hexanone

Name
2-Hexanone
InChI
InChI=1S/C6H12O/c1-3-4-5-6(2)7/h3-5H2,1-2H3
InChI Key
QQZOPKMRPOGIEB-UHFFFAOYSA-N
Formula
C6H12O
SMILES
CCCCC(C)=O
Mol. Weight (g/mol)
100.16
CAS
591-78-6

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
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Datasets

  1. Mole fraction (4)

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Phenol (2) - Liquid mixture 2 Mole fraction of 2-Hexanone (1) - Liquid mixture 2 Mole fraction of Phenol (2) - Liquid mixture 1 Mole fraction of 2-Hexanone (1) - Liquid mixture 1
0.0003 0.0021 0.1118 0.6860
0.0001 0.0022 0.0292 0.8195
0.0001 0.0022 0.0269 0.8232
0.0000 0.0022 0.0182 0.8374
0.0000 0.0022 0.0000 0.8672
0.0003 0.0021 0.0991 0.7065
0.0002 0.0021 0.0772 0.7419
0.0001 0.0021 0.0574 0.7740
0.0001 0.0021 0.0447 0.7945
0.0001 0.0022 0.0372 0.8066

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 101 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of 2-Hexanone (1) - Liquid mixture 1 Mass fraction of Phenol (2) - Liquid mixture 1 Mass fraction of Phenol (2) - Liquid mixture 2 Mass fraction of 2-Hexanone (1) - Liquid mixture 2
298.15 0.8639 0.0982 0.0011 0.0121
298.15 0.8894 0.0751 0.0007 0.0124
298.15 0.8989 0.0665 0.0007 0.0124
298.15 0.9559 0.0180 0.0002 0.0126
298.15 0.9195 0.0483 0.0004 0.0125
298.15 0.9217 0.0474 0.0004 0.0125
298.15 0.9358 0.0329 0.0003 0.0126
298.15 0.9432 0.0279 0.0003 0.0126
298.15 0.9500 0.0227 0.0002 0.0126
298.15 0.9773 0.0000 0.0000 0.0158
323.15 0.7004 0.2408 0.0051 0.0079
323.15 0.8965 0.0655 0.0010 0.0097
323.15 0.7607 0.1861 0.0039 0.0083
323.15 0.8042 0.1511 0.0028 0.0088
323.15 0.8307 0.1270 0.0021 0.0093
323.15 0.8488 0.1123 0.0016 0.0095
323.15 0.8729 0.0889 0.0012 0.0097
323.15 0.9080 0.0543 0.0008 0.0098
298.15 0.8803 0.0836 0.0009 0.0122
323.15 0.9211 0.0436 0.0005 0.0098
323.15 0.9273 0.0379 0.0005 0.0098
323.15 0.9352 0.0313 0.0004 0.0098
323.15 0.9476 0.0198 0.0003 0.0098
323.15 0.9709 0.0000 0.0000 0.0109

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Phenol (2) - Liquid mixture 2 Mole fraction of 2-Hexanone (1) - Liquid mixture 2 Mole fraction of Phenol (2) - Liquid mixture 1 Mole fraction of 2-Hexanone (1) - Liquid mixture 1
0.0003 0.0021 0.1118 0.6860
0.0001 0.0022 0.0292 0.8195
0.0001 0.0022 0.0269 0.8232
0.0000 0.0022 0.0182 0.8374
0.0000 0.0022 0.0000 0.8672
0.0003 0.0021 0.0991 0.7065
0.0002 0.0021 0.0772 0.7419
0.0001 0.0021 0.0574 0.7740
0.0001 0.0021 0.0447 0.7945
0.0001 0.0022 0.0372 0.8066

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 101 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of 2-Hexanone (1) - Liquid mixture 1 Mass fraction of Phenol (2) - Liquid mixture 1 Mass fraction of Phenol (2) - Liquid mixture 2 Mass fraction of 2-Hexanone (1) - Liquid mixture 2
298.15 0.8639 0.0982 0.0011 0.0121
298.15 0.8894 0.0751 0.0007 0.0124
298.15 0.8989 0.0665 0.0007 0.0124
298.15 0.9559 0.0180 0.0002 0.0126
298.15 0.9195 0.0483 0.0004 0.0125
298.15 0.9217 0.0474 0.0004 0.0125
298.15 0.9358 0.0329 0.0003 0.0126
298.15 0.9432 0.0279 0.0003 0.0126
298.15 0.9500 0.0227 0.0002 0.0126
298.15 0.9773 0.0000 0.0000 0.0158
323.15 0.7004 0.2408 0.0051 0.0079
323.15 0.8965 0.0655 0.0010 0.0097
323.15 0.7607 0.1861 0.0039 0.0083
323.15 0.8042 0.1511 0.0028 0.0088
323.15 0.8307 0.1270 0.0021 0.0093
323.15 0.8488 0.1123 0.0016 0.0095
323.15 0.8729 0.0889 0.0012 0.0097
323.15 0.9080 0.0543 0.0008 0.0098
298.15 0.8803 0.0836 0.0009 0.0122
323.15 0.9211 0.0436 0.0005 0.0098
323.15 0.9273 0.0379 0.0005 0.0098
323.15 0.9352 0.0313 0.0004 0.0098
323.15 0.9476 0.0198 0.0003 0.0098
323.15 0.9709 0.0000 0.0000 0.0109

Sources