Mixture of Phenol, 3-methyl- + 2-Butanone, 3,3-dimethyl- + Water

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Phenol, 3-methyl-

Name
Phenol, 3-methyl-
InChI
InChI=1S/C7H8O/c1-6-3-2-4-7(8)5-6/h2-5,8H,1H3
InChI Key
RLSSMJSEOOYNOY-UHFFFAOYSA-N
Formula
C7H8O
SMILES
Cc1cccc(O)c1
Mol. Weight (g/mol)
108.14
CAS
108-39-4

2-Butanone, 3,3-dimethyl-

Name
2-Butanone, 3,3-dimethyl-
InChI
InChI=1S/C6H12O/c1-5(7)6(2,3)4/h1-4H3
InChI Key
PJGSXYOJTGTZAV-UHFFFAOYSA-N
Formula
C6H12O
SMILES
CC(=O)C(C)(C)C
Mol. Weight (g/mol)
100.16
CAS
75-97-8

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. Temperature, K x Mass fraction (4)

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of 2-Butanone, 3,3-dimethyl- (2) - Liquid mixture 1 Mass fraction of Phenol, 3-methyl- (1) - Liquid mixture 1 Mass fraction of Phenol, 3-methyl- (1) - Liquid mixture 2 Mass fraction of 2-Butanone, 3,3-dimethyl- (2) - Liquid mixture 2
298.20 0.6407 0.3172 0.0024 0.0079
298.20 0.9853 0.0000 0.0000 0.0171
313.20 0.6372 0.3185 0.0025 0.0077
313.20 0.6969 0.2617 0.0019 0.0075
313.20 0.7320 0.2329 0.0015 0.0100
313.20 0.7625 0.2041 0.0012 0.0101
313.20 0.7961 0.1722 0.0010 0.0104
313.20 0.8267 0.1427 0.0007 0.0109
313.20 0.8400 0.1298 0.0006 0.0113
313.20 0.8690 0.1022 0.0005 0.0116
313.20 0.8942 0.0782 0.0003 0.0121
298.20 0.6613 0.2994 0.0020 0.0084
313.20 0.9827 0.0000 0.0000 0.0159
323.20 0.6352 0.3167 0.0027 0.0071
323.20 0.6914 0.2615 0.0021 0.0089
323.20 0.7389 0.2147 0.0016 0.0098
323.20 0.7531 0.2009 0.0013 0.0102
323.20 0.7810 0.1765 0.0011 0.0105
323.20 0.8016 0.1586 0.0009 0.0106
323.20 0.8172 0.1473 0.0008 0.0108
323.20 0.8375 0.1292 0.0006 0.0109
323.20 0.8590 0.1082 0.0005 0.0114
298.20 0.6989 0.2659 0.0015 0.0109
323.20 0.9807 0.0000 0.0000 0.0141
298.20 0.7299 0.2389 0.0014 0.0113
298.20 0.7479 0.2173 0.0011 0.0120
298.20 0.7564 0.2094 0.0010 0.0124
298.20 0.7663 0.2006 0.0009 0.0130
298.20 0.7823 0.1864 0.0008 0.0133
298.20 0.7988 0.1729 0.0006 0.0145

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of 2-Butanone, 3,3-dimethyl- (2) - Liquid mixture 2 Mole fraction of Phenol, 3-methyl- (1) - Liquid mixture 2 Mole fraction of 2-Butanone, 3,3-dimethyl- (2) - Liquid mixture 1 Mole fraction of Phenol, 3-methyl- (1) - Liquid mixture 1
333.20 0.8184 0.0507 0.0022 0.0001
333.20 0.6120 0.1775 0.0022 0.0002
333.20 0.5254 0.2282 0.0021 0.0003
333.20 0.4483 0.2704 0.0021 0.0005
333.20 0.3836 0.3014 0.0020 0.0007
333.20 0.3302 0.3369 0.0019 0.0010
333.20 0.2332 0.3840 0.0018 0.0017
353.20 0.8092 0.0399 0.0022 0.0001
353.20 0.7027 0.1045 0.0022 0.0001
353.20 0.6009 0.1551 0.0022 0.0003
353.20 0.5197 0.2095 0.0021 0.0004
353.20 0.4047 0.2634 0.0020 0.0007
353.20 0.3416 0.2911 0.0019 0.0011
353.20 0.2814 0.3155 0.0019 0.0018
353.20 0.2399 0.3366 0.0017 0.0026
333.20 0.7079 0.1133 0.0022 0.0001

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of 2-Butanone, 3,3-dimethyl- (2) - Liquid mixture 1 Mass fraction of Phenol, 3-methyl- (1) - Liquid mixture 1 Mass fraction of Phenol, 3-methyl- (1) - Liquid mixture 2 Mass fraction of 2-Butanone, 3,3-dimethyl- (2) - Liquid mixture 2
298.20 0.6407 0.3172 0.0024 0.0079
298.20 0.9853 0.0000 0.0000 0.0171
313.20 0.6372 0.3185 0.0025 0.0077
313.20 0.6969 0.2617 0.0019 0.0075
313.20 0.7320 0.2329 0.0015 0.0100
313.20 0.7625 0.2041 0.0012 0.0101
313.20 0.7961 0.1722 0.0010 0.0104
313.20 0.8267 0.1427 0.0007 0.0109
313.20 0.8400 0.1298 0.0006 0.0113
313.20 0.8690 0.1022 0.0005 0.0116
313.20 0.8942 0.0782 0.0003 0.0121
298.20 0.6613 0.2994 0.0020 0.0084
313.20 0.9827 0.0000 0.0000 0.0159
323.20 0.6352 0.3167 0.0027 0.0071
323.20 0.6914 0.2615 0.0021 0.0089
323.20 0.7389 0.2147 0.0016 0.0098
323.20 0.7531 0.2009 0.0013 0.0102
323.20 0.7810 0.1765 0.0011 0.0105
323.20 0.8016 0.1586 0.0009 0.0106
323.20 0.8172 0.1473 0.0008 0.0108
323.20 0.8375 0.1292 0.0006 0.0109
323.20 0.8590 0.1082 0.0005 0.0114
298.20 0.6989 0.2659 0.0015 0.0109
323.20 0.9807 0.0000 0.0000 0.0141
298.20 0.7299 0.2389 0.0014 0.0113
298.20 0.7479 0.2173 0.0011 0.0120
298.20 0.7564 0.2094 0.0010 0.0124
298.20 0.7663 0.2006 0.0009 0.0130
298.20 0.7823 0.1864 0.0008 0.0133
298.20 0.7988 0.1729 0.0006 0.0145

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of 2-Butanone, 3,3-dimethyl- (2) - Liquid mixture 2 Mole fraction of Phenol, 3-methyl- (1) - Liquid mixture 2 Mole fraction of 2-Butanone, 3,3-dimethyl- (2) - Liquid mixture 1 Mole fraction of Phenol, 3-methyl- (1) - Liquid mixture 1
333.20 0.8184 0.0507 0.0022 0.0001
333.20 0.6120 0.1775 0.0022 0.0002
333.20 0.5254 0.2282 0.0021 0.0003
333.20 0.4483 0.2704 0.0021 0.0005
333.20 0.3836 0.3014 0.0020 0.0007
333.20 0.3302 0.3369 0.0019 0.0010
333.20 0.2332 0.3840 0.0018 0.0017
353.20 0.8092 0.0399 0.0022 0.0001
353.20 0.7027 0.1045 0.0022 0.0001
353.20 0.6009 0.1551 0.0022 0.0003
353.20 0.5197 0.2095 0.0021 0.0004
353.20 0.4047 0.2634 0.0020 0.0007
353.20 0.3416 0.2911 0.0019 0.0011
353.20 0.2814 0.3155 0.0019 0.0018
353.20 0.2399 0.3366 0.0017 0.0026
333.20 0.7079 0.1133 0.0022 0.0001

Sources