Mixture of n-Hexane + Choline chloride + Diethanolamine

Excel

n-Hexane

Name
n-Hexane
InChI
InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3
InChI Key
VLKZOEOYAKHREP-UHFFFAOYSA-N
Formula
C6H14
SMILES
CCCCCC
Mol. Weight (g/mol)
86.18
CAS
110-54-3

Choline chloride

Name
Choline chloride
InChI
InChI=1S/C5H14NO.ClH/c1-6(2,3)4-5-7;/h7H,4-5H2,1-3H3;1H/q+1;/p-1
InChI Key
SGMZJAMFUVOLNK-UHFFFAOYSA-M
Formula
C5H14ClNO
SMILES
C[N+](C)(C)CCO.[Cl-]
Mol. Weight (g/mol)
139.62
CAS
67-48-1

Diethanolamine

Name
Diethanolamine
InChI
InChI=1S/C4H11NO2/c6-3-1-5-2-4-7/h5-7H,1-4H2
InChI Key
ZBCBWPMODOFKDW-UHFFFAOYSA-N
Formula
C4H11NO2
SMILES
OCCNCCO
Mol. Weight (g/mol)
105.14
CAS
111-42-2
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Datasets

  1. Mole fraction (2)

Mole fraction of n-Hexane (1) [ref]

Operational conditions:

Solvent: Mole fraction of Choline chloride (2) - Liquid mixture 1 Mole fraction of n-Hexane (1) - Liquid mixture 1
0.1670 0.0150
0.1250 0.0110

Mole fraction of n-Hexane (1) [ref]

Operational conditions:

Solvent: Mole fraction of Choline chloride (2) - Liquid mixture 1 Mole fraction of n-Hexane (1) - Liquid mixture 1
0.1670 0.0150
0.1250 0.0110

Sources