Mixture of n-Hexane + Isopropyl Alcohol + Water

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

Isopropyl Alcohol

Name
Isopropyl Alcohol
InChI
InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3
InChI Key
KFZMGEQAYNKOFK-UHFFFAOYSA-N
Formula
C3H8O
SMILES
CC(C)O
Mol. Weight (g/mol)
60.09
CAS
67-63-0

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. Temperature, K x Mole fraction (4)
  2. Vapor Liquid Equilibrium at Constant Pressure

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of n-Hexane (1) - Liquid mixture 2 Mole fraction of Isopropyl Alcohol (2) - Liquid mixture 2 Mole fraction of n-Hexane (1) - Liquid mixture 1 Mole fraction of Isopropyl Alcohol (2) - Liquid mixture 1
303.00 0.9910 0.0060 0.0040 0.0160
303.00 0.3090 0.4120 0.2040 0.4230
313.00 0.9910 0.0060 0.0140 0.0150
313.00 0.9720 0.0200 0.0100 0.0580
313.00 0.8540 0.1200 0.0120 0.1420
313.00 0.7260 0.2190 0.0240 0.2260
313.00 0.6130 0.2850 0.0290 0.3260
313.00 0.4990 0.3380 0.0520 0.3750
313.00 0.4370 0.3690 0.0690 0.4050
313.00 0.3890 0.3880 0.0950 0.4200
313.00 0.3370 0.3970 0.1290 0.4170
303.00 0.9690 0.0240 0.0000 0.0590
313.00 0.2820 0.4160 0.1770 0.4230
323.00 0.9910 0.0060 0.0080 0.0350
323.00 0.8950 0.0850 0.0140 0.1070
323.00 0.7970 0.1710 0.0290 0.1860
323.00 0.6820 0.2490 0.0240 0.2700
323.00 0.5760 0.3050 0.0390 0.3220
323.00 0.5320 0.3270 0.0690 0.3570
323.00 0.4590 0.3500 0.0710 0.3830
323.00 0.3670 0.3860 0.0940 0.4040
323.00 0.3060 0.4030 0.1450 0.4110
303.00 0.8730 0.1090 0.0010 0.1140
323.00 0.2860 0.4040 0.1870 0.4120
303.00 0.7680 0.1880 0.0030 0.1850
303.00 0.6440 0.2730 0.0130 0.2850
303.00 0.5100 0.3430 0.0420 0.3570
303.00 0.4710 0.3570 0.0720 0.3900
303.00 0.1120 0.4200 0.3740 0.3960
303.00 0.1550 0.4200 0.3460 0.4010

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Water (3) - Liquid mixture 1 Mole fraction of n-Hexane (1) - Liquid mixture 1 Mole fraction of n-Hexane (1) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 2
0.9910 0.0030 0.4250 0.5480
0.9840 0.0040 0.3830 0.5640
0.9650 0.0060 0.2750 0.6260
0.9530 0.0080 0.2390 0.6480
0.9760 0.0060 0.3350 0.5920
0.9280 0.0160 0.1660 0.7030
0.9110 0.0210 0.1260 0.7450
0.8960 0.0280 0.1110 0.7620

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of n-Hexane (1) - Liquid mixture 2 Mole fraction of Isopropyl Alcohol (2) - Liquid mixture 2 Mole fraction of n-Hexane (1) - Liquid mixture 1 Mole fraction of Isopropyl Alcohol (2) - Liquid mixture 1
303.00 0.9910 0.0060 0.0040 0.0160
303.00 0.3090 0.4120 0.2040 0.4230
313.00 0.9910 0.0060 0.0140 0.0150
313.00 0.9720 0.0200 0.0100 0.0580
313.00 0.8540 0.1200 0.0120 0.1420
313.00 0.7260 0.2190 0.0240 0.2260
313.00 0.6130 0.2850 0.0290 0.3260
313.00 0.4990 0.3380 0.0520 0.3750
313.00 0.4370 0.3690 0.0690 0.4050
313.00 0.3890 0.3880 0.0950 0.4200
313.00 0.3370 0.3970 0.1290 0.4170
303.00 0.9690 0.0240 0.0000 0.0590
313.00 0.2820 0.4160 0.1770 0.4230
323.00 0.9910 0.0060 0.0080 0.0350
323.00 0.8950 0.0850 0.0140 0.1070
323.00 0.7970 0.1710 0.0290 0.1860
323.00 0.6820 0.2490 0.0240 0.2700
323.00 0.5760 0.3050 0.0390 0.3220
323.00 0.5320 0.3270 0.0690 0.3570
323.00 0.4590 0.3500 0.0710 0.3830
323.00 0.3670 0.3860 0.0940 0.4040
323.00 0.3060 0.4030 0.1450 0.4110
303.00 0.8730 0.1090 0.0010 0.1140
323.00 0.2860 0.4040 0.1870 0.4120
303.00 0.7680 0.1880 0.0030 0.1850
303.00 0.6440 0.2730 0.0130 0.2850
303.00 0.5100 0.3430 0.0420 0.3570
303.00 0.4710 0.3570 0.0720 0.3900
303.00 0.1120 0.4200 0.3740 0.3960
303.00 0.1550 0.4200 0.3460 0.4010

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Water (3) - Liquid mixture 1 Mole fraction of n-Hexane (1) - Liquid mixture 1 Mole fraction of n-Hexane (1) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 2
0.9910 0.0030 0.4250 0.5480
0.9840 0.0040 0.3830 0.5640
0.9650 0.0060 0.2750 0.6260
0.9530 0.0080 0.2390 0.6480
0.9760 0.0060 0.3350 0.5920
0.9280 0.0160 0.1660 0.7030
0.9110 0.0210 0.1260 0.7450
0.8960 0.0280 0.1110 0.7620

Vapor Liquid Equilibrium at Constant Pressure [ref]

Operational condition: Pressure, kPa = 101.33 (VLE)

Fixed Measured
x1[mol/mol] of Water (3) - Liquid x2[mol/mol] of Isopropyl Alcohol (2) - Liquid y1[mol/mol] of Water (3) - Vapour y2[mol/mol] of Isopropyl Alcohol (2) - Vapour
0.5890 0.1030 0.0370 0.2170
0.1920 0.2000 0.0430 0.2050
0.0670 0.3820 0.0300 0.2000
0.0410 0.8480 0.0670 0.4480
0.0230 0.9370 0.0360 0.9460
0.0160 0.7560 0.2250 0.1400
0.2160 0.7690 0.2260 0.6080
0.3560 0.2140 0.2270 0.2060
0.5720 0.2700 0.2250 0.3450
0.2840 0.3360 0.2200 0.0650

Sources