Mixture of Cyclohexanone + Isophorone + Water

Excel

Cyclohexanone

Name
Cyclohexanone
InChI
InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2
InChI Key
JHIVVAPYMSGYDF-UHFFFAOYSA-N
Formula
C6H10O
SMILES
O=C1CCCCC1
Mol. Weight (g/mol)
98.14
CAS
108-94-1

Isophorone

Name
Isophorone
InChI
InChI=1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3
InChI Key
HJOVHMDZYOCNQW-UHFFFAOYSA-N
Formula
C9H14O
SMILES
CC1=CC(=O)CC(C)(C)C1
Mol. Weight (g/mol)
138.21
CAS
78-59-1

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 = 101.3 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 1 Mass fraction of Cyclohexanone (1) - Liquid mixture 2 Mass fraction of Water (3) - Liquid mixture 2 Mass fraction of Water (3) - Liquid mixture 1 Mass fraction of Cyclohexanone (1) - Liquid mixture 1
308.15 0.0198 0.9517 0.0431 0.1821
328.15 0.0097 0.9550 0.0415 0.0915
328.15 0.0194 0.9457 0.0430 0.1807
308.15 0.0250 0.9474 0.0442 0.2293
328.15 0.0244 0.9420 0.0457 0.2235
328.15 0.0289 0.9397 0.0487 0.2711
328.15 0.0375 0.9369 0.0521 0.3685
328.15 0.0457 0.9314 0.0549 0.4469
328.15 0.0547 0.9229 0.0553 0.5064
308.15 0.0363 0.9363 0.0466 0.3234
308.15 0.0406 0.9340 0.0492 0.3692
318.15 0.0132 0.9612 0.0453 0.1385
308.15 0.0511 0.9252 0.0517 0.4494
308.15 0.0564 0.9209 0.0526 0.4923
308.15 0.0610 0.9177 0.0528 0.5255
308.15 0.0655 0.9140 0.0528 0.5532
318.15 0.0088 0.9642 0.0426 0.0923
318.15 0.0174 0.9574 0.0458 0.1819
318.15 0.0263 0.9516 0.0471 0.2778
318.15 0.0303 0.9493 0.0484 0.3262
318.15 0.0349 0.9464 0.0486 0.3771
318.15 0.0404 0.9415 0.0488 0.4236
318.15 0.0444 0.9404 0.0507 0.4717
328.15 0.0046 0.9558 0.0406 0.0441

Temperature, K x Mass fraction [ref]

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

Fixed Measured
Temperature, K - Liquid mixture 1 Mass fraction of Cyclohexanone (1) - Liquid mixture 2 Mass fraction of Water (3) - Liquid mixture 2 Mass fraction of Water (3) - Liquid mixture 1 Mass fraction of Cyclohexanone (1) - Liquid mixture 1
308.15 0.0198 0.9517 0.0431 0.1821
328.15 0.0097 0.9550 0.0415 0.0915
328.15 0.0194 0.9457 0.0430 0.1807
308.15 0.0250 0.9474 0.0442 0.2293
328.15 0.0244 0.9420 0.0457 0.2235
328.15 0.0289 0.9397 0.0487 0.2711
328.15 0.0375 0.9369 0.0521 0.3685
328.15 0.0457 0.9314 0.0549 0.4469
328.15 0.0547 0.9229 0.0553 0.5064
308.15 0.0363 0.9363 0.0466 0.3234
308.15 0.0406 0.9340 0.0492 0.3692
318.15 0.0132 0.9612 0.0453 0.1385
308.15 0.0511 0.9252 0.0517 0.4494
308.15 0.0564 0.9209 0.0526 0.4923
308.15 0.0610 0.9177 0.0528 0.5255
308.15 0.0655 0.9140 0.0528 0.5532
318.15 0.0088 0.9642 0.0426 0.0923
318.15 0.0174 0.9574 0.0458 0.1819
318.15 0.0263 0.9516 0.0471 0.2778
318.15 0.0303 0.9493 0.0484 0.3262
318.15 0.0349 0.9464 0.0486 0.3771
318.15 0.0404 0.9415 0.0488 0.4236
318.15 0.0444 0.9404 0.0507 0.4717
328.15 0.0046 0.9558 0.0406 0.0441

Sources