Mixture of Methyl Isobutyl Ketone + Isoquinoline + Water

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Methyl Isobutyl Ketone

Name
Methyl Isobutyl Ketone
InChI
InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3
InChI Key
NTIZESTWPVYFNL-UHFFFAOYSA-N
Formula
C6H12O
SMILES
CC(=O)CC(C)C
Mol. Weight (g/mol)
100.16
CAS
108-10-1

Isoquinoline

Name
Isoquinoline
InChI
InChI=1S/C9H7N/c1-2-4-9-7-10-6-5-8(9)3-1/h1-7H
InChI Key
AWJUIBRHMBBTKR-UHFFFAOYSA-N
Formula
C9H7N
SMILES
c1ccc2cnccc2c1
Mol. Weight (g/mol)
129.16
CAS
119-65-3

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 (2)

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 100 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of Methyl Isobutyl Ketone (1) - Liquid mixture 1 Mass fraction of Isoquinoline (2) - Liquid mixture 1 Mass fraction of Isoquinoline (2) - Liquid mixture 2 Mass fraction of Methyl Isobutyl Ketone (1) - Liquid mixture 2
298.15 0.0158 0.0004 0.0452 0.9205
318.15 0.0143 0.0007 0.0675 0.8788
318.15 0.0142 0.0014 0.1320 0.8021
318.15 0.0140 0.0019 0.1724 0.7610
318.15 0.0137 0.0026 0.2297 0.6931
318.15 0.0134 0.0032 0.2711 0.6526
318.15 0.0131 0.0038 0.3103 0.6097
318.15 0.0128 0.0045 0.3597 0.5601
338.15 0.0136 0.0004 0.0452 0.8982
338.15 0.0134 0.0012 0.1064 0.8313
338.15 0.0132 0.0017 0.1471 0.7778
298.15 0.0157 0.0010 0.0961 0.8653
338.15 0.0131 0.0024 0.1993 0.7173
338.15 0.0129 0.0030 0.2406 0.6672
338.15 0.0125 0.0039 0.3029 0.6045
338.15 0.0123 0.0047 0.3473 0.5545
338.15 0.0121 0.0051 0.3685 0.5259
298.15 0.0156 0.0015 0.1403 0.8138
298.15 0.0155 0.0019 0.1751 0.7735
298.15 0.0152 0.0026 0.2343 0.7132
298.15 0.0151 0.0031 0.2752 0.6657
298.15 0.0147 0.0037 0.3214 0.6218
298.15 0.0145 0.0043 0.3646 0.5724
318.15 0.0144 0.0003 0.0360 0.9197
298.15 0.0163 0.0000 0.0000 0.9763
318.15 0.0152 0.0000 0.0000 0.9725
338.15 0.0137 0.0000 0.0000 0.9666

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 100 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of Methyl Isobutyl Ketone (1) - Liquid mixture 1 Mass fraction of Isoquinoline (2) - Liquid mixture 1 Mass fraction of Isoquinoline (2) - Liquid mixture 2 Mass fraction of Methyl Isobutyl Ketone (1) - Liquid mixture 2
298.15 0.0158 0.0004 0.0452 0.9205
318.15 0.0143 0.0007 0.0675 0.8788
318.15 0.0142 0.0014 0.1320 0.8021
318.15 0.0140 0.0019 0.1724 0.7610
318.15 0.0137 0.0026 0.2297 0.6931
318.15 0.0134 0.0032 0.2711 0.6526
318.15 0.0131 0.0038 0.3103 0.6097
318.15 0.0128 0.0045 0.3597 0.5601
338.15 0.0136 0.0004 0.0452 0.8982
338.15 0.0134 0.0012 0.1064 0.8313
338.15 0.0132 0.0017 0.1471 0.7778
298.15 0.0157 0.0010 0.0961 0.8653
338.15 0.0131 0.0024 0.1993 0.7173
338.15 0.0129 0.0030 0.2406 0.6672
338.15 0.0125 0.0039 0.3029 0.6045
338.15 0.0123 0.0047 0.3473 0.5545
338.15 0.0121 0.0051 0.3685 0.5259
298.15 0.0156 0.0015 0.1403 0.8138
298.15 0.0155 0.0019 0.1751 0.7735
298.15 0.0152 0.0026 0.2343 0.7132
298.15 0.0151 0.0031 0.2752 0.6657
298.15 0.0147 0.0037 0.3214 0.6218
298.15 0.0145 0.0043 0.3646 0.5724
318.15 0.0144 0.0003 0.0360 0.9197
298.15 0.0163 0.0000 0.0000 0.9763
318.15 0.0152 0.0000 0.0000 0.9725
338.15 0.0137 0.0000 0.0000 0.9666

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