Mixture of Benzo[b]thiophene + Heptane + Ethanol, 2,2'-oxybis-

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Benzo[b]thiophene

Name
Benzo[b]thiophene
InChI
InChI=1S/C8H6S/c1-2-4-8-7(3-1)5-6-9-8/h1-6H
InChI Key
FCEHBMOGCRZNNI-UHFFFAOYSA-N
Formula
C8H6S
SMILES
c1ccc2sccc2c1
Mol. Weight (g/mol)
134.20
CAS
95-15-8

Heptane

Name
Heptane
InChI
InChI=1S/C7H16/c1-3-5-7-6-4-2/h3-7H2,1-2H3
InChI Key
IMNFDUFMRHMDMM-UHFFFAOYSA-N
Formula
C7H16
SMILES
CCCCCCC
Mol. Weight (g/mol)
100.20
CAS
142-82-5

Ethanol, 2,2'-oxybis-

Name
Ethanol, 2,2'-oxybis-
InChI
InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2
InChI Key
MTHSVFCYNBDYFN-UHFFFAOYSA-N
Formula
C4H10O3
SMILES
OCCOCCO
Mol. Weight (g/mol)
106.12
CAS
111-46-6
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Datasets

  1. Mole fraction (2)

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Benzo[b]thiophene (1) - Liquid mixture 2 Mole fraction of Heptane (2) - Liquid mixture 2 Mole fraction of Heptane (2) - Liquid mixture 1 Mole fraction of Benzo[b]thiophene (1) - Liquid mixture 1
0.0000 0.0080 0.9960 0.0000
0.0060 0.0100 0.9870 0.0070
0.0580 0.0110 0.8980 0.1000
0.1050 0.0140 0.8120 0.1870
0.1710 0.0180 0.7260 0.2730
0.1810 0.0140 0.6520 0.3470
0.2080 0.0190 0.5850 0.4100
0.2200 0.0220 0.5230 0.4720
0.2480 0.0230 0.4480 0.5450
0.2590 0.0190 0.3850 0.6040
0.2770 0.0240 0.3410 0.6500
0.3060 0.0230 0.2980 0.6870
0.3230 0.0260 0.2670 0.7120
0.3520 0.0260 0.2030 0.7690
0.3840 0.0260 0.1570 0.8020
0.3920 0.0270 0.1260 0.8140
0.5270 0.0240 0.0470 0.8170
0.5020 0.0240 0.0610 0.8220
0.4270 0.0240 0.0910 0.8320

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Benzo[b]thiophene (1) - Liquid mixture 2 Mole fraction of Heptane (2) - Liquid mixture 2 Mole fraction of Heptane (2) - Liquid mixture 1 Mole fraction of Benzo[b]thiophene (1) - Liquid mixture 1
0.0000 0.0080 0.9960 0.0000
0.0060 0.0100 0.9870 0.0070
0.0580 0.0110 0.8980 0.1000
0.1050 0.0140 0.8120 0.1870
0.1710 0.0180 0.7260 0.2730
0.1810 0.0140 0.6520 0.3470
0.2080 0.0190 0.5850 0.4100
0.2200 0.0220 0.5230 0.4720
0.2480 0.0230 0.4480 0.5450
0.2590 0.0190 0.3850 0.6040
0.2770 0.0240 0.3410 0.6500
0.3060 0.0230 0.2980 0.6870
0.3230 0.0260 0.2670 0.7120
0.3520 0.0260 0.2030 0.7690
0.3840 0.0260 0.1570 0.8020
0.3920 0.0270 0.1260 0.8140
0.5270 0.0240 0.0470 0.8170
0.5020 0.0240 0.0610 0.8220
0.4270 0.0240 0.0910 0.8320

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