Mixture of 1,4-Butanediol + 1-Hexanol, 2-ethyl- + Water

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1,4-Butanediol

Name
1,4-Butanediol
InChI
InChI=1S/C4H10O2/c5-3-1-2-4-6/h5-6H,1-4H2
InChI Key
WERYXYBDKMZEQL-UHFFFAOYSA-N
Formula
C4H10O2
SMILES
OCCCCO
Mol. Weight (g/mol)
90.12
CAS
110-63-4

1-Hexanol, 2-ethyl-

Name
1-Hexanol, 2-ethyl-
InChI
InChI=1S/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3
InChI Key
YIWUKEYIRIRTPP-UHFFFAOYSA-N
Formula
C8H18O
SMILES
CCCCC(CC)CO
Mol. Weight (g/mol)
130.23
CAS
104-76-7

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. Mole fraction (2)

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of 1,4-Butanediol (1) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 1 Mole fraction of 1,4-Butanediol (1) - Liquid mixture 1
0.0390 0.0229 0.9284 0.0681
0.0509 0.0237 0.8641 0.1296
0.0519 0.0239 0.7611 0.2279
0.0596 0.0245 0.7300 0.2574
0.1101 0.0287 0.5111 0.4640

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of 1,4-Butanediol (1) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 1 Mole fraction of 1,4-Butanediol (1) - Liquid mixture 1
0.0390 0.0229 0.9284 0.0681
0.0509 0.0237 0.8641 0.1296
0.0519 0.0239 0.7611 0.2279
0.0596 0.0245 0.7300 0.2574
0.1101 0.0287 0.5111 0.4640

Sources