Mixture of Acetonitrile + Octane + Water

Acetonitrile

Name
Acetonitrile
InChI
InChI=1S/C2H3N/c1-2-3/h1H3
InChI Key
WEVYAHXRMPXWCK-UHFFFAOYSA-N
Formula
C2H3N
SMILES
CC#N
Mol. Weight (g/mol)
41.05
CAS
75-05-8

Octane

Name
Octane
InChI
InChI=1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3
InChI Key
TVMXDCGIABBOFY-UHFFFAOYSA-N
Formula
C8H18
SMILES
CCCCCCCC
Mol. Weight (g/mol)
114.23
CAS
111-65-9

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. Activity coefficient (2)

Activity coefficient of Octane (2) [ref]

Operational conditions:

Solvent: Mole fraction of Water (3) - Liquid Activity coefficient of Octane (2) - Liquid
0.0000 52.3
0.1000 87.1
0.2000 130.0
0.3000 214.0
0.4000 343.0
0.5000 616.0
0.6000 1160.0
0.7000 2774.0
0.7500 4727.0
0.8000 9781.0

Activity coefficient of Octane (2) [ref]

Operational conditions:

Solvent: Mole fraction of Water (3) - Liquid Activity coefficient of Octane (2) - Liquid
0.0000 52.3
0.1000 87.1
0.2000 130.0
0.3000 214.0
0.4000 343.0
0.5000 616.0
0.6000 1160.0
0.7000 2774.0
0.7500 4727.0
0.8000 9781.0

Sources

Note: These property values are available through the Cheméo API. A free account gives you an access key.