Mixture of 1-Heptyne + 1,2-Ethanediol + Tetramethylammonium chloride

Excel

1-Heptyne

Name
1-Heptyne
InChI
InChI=1S/C7H12/c1-3-5-7-6-4-2/h1H,4-7H2,2H3
InChI Key
YVXHZKKCZYLQOP-UHFFFAOYSA-N
Formula
C7H12
SMILES
C#CCCCCC
Mol. Weight (g/mol)
96.17
CAS
628-71-7

1,2-Ethanediol

Name
1,2-Ethanediol
InChI
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI Key
LYCAIKOWRPUZTN-UHFFFAOYSA-N
Formula
C2H6O2
SMILES
OCCO
Mol. Weight (g/mol)
62.07
CAS
107-21-1

Tetramethylammonium chloride

Name
Tetramethylammonium chloride
InChI
InChI=1S/C4H12N.ClH/c1-5(2,3)4;/h1-4H3;1H/q+1;/p-1
InChI Key
OKIZCWYLBDKLSU-UHFFFAOYSA-M
Formula
C4H12ClN
SMILES
C[N+](C)(C)C.[Cl-]
Mol. Weight (g/mol)
109.60
CAS
75-57-0
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. Activity coefficient (2)

Activity coefficient of 1-Heptyne (1) [ref]

Operational conditions:

Temperature, K - Liquid Activity coefficient of 1-Heptyne (1) - Liquid
313.15 41.284
323.15 40.655
333.15 37.014
343.15 34.664
313.15 41.036
323.15 39.129
333.15 37.743
343.15 35.848

Activity coefficient of 1-Heptyne (1) [ref]

Operational conditions:

Temperature, K - Liquid Activity coefficient of 1-Heptyne (1) - Liquid
313.15 41.284
323.15 40.655
333.15 37.014
343.15 34.664
313.15 41.036
323.15 39.129
333.15 37.743
343.15 35.848

Sources