Mixture of 1-Propanol + Propanoic acid, propyl ester + Water

Excel

1-Propanol

Name
1-Propanol
InChI
InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3
InChI Key
BDERNNFJNOPAEC-UHFFFAOYSA-N
Formula
C3H8O
SMILES
CCCO
Mol. Weight (g/mol)
60.09
CAS
71-23-8

Propanoic acid, propyl ester

Name
Propanoic acid, propyl ester
InChI
InChI=1S/C6H12O2/c1-3-5-8-6(7)4-2/h3-5H2,1-2H3
InChI Key
MCSINKKTEDDPNK-UHFFFAOYSA-N
Formula
C6H12O2
SMILES
CCCOC(=O)CC
Mol. Weight (g/mol)
116.16
CAS
106-36-5

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
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. Temperature, K x Mole fraction (4)

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mole fraction of 1-Propanol (1) - Liquid mixture 1 Mole fraction of Propanoic acid, propyl ester (2) - Liquid mixture 1 Mole fraction of 1-Propanol (1) - Liquid mixture 2 Mole fraction of Propanoic acid, propyl ester (2) - Liquid mixture 2
293.15 0.0000 0.0010 0.0000 0.9410
293.15 0.0520 0.0050 0.3890 0.2290
293.15 0.0530 0.0050 0.3850 0.1920
293.15 0.0560 0.0050 0.3770 0.1540
293.15 0.0680 0.0050 0.3300 0.0860
313.15 0.0000 0.0020 0.0000 0.9260
313.15 0.0100 0.0030 0.0790 0.8200
313.15 0.0170 0.0030 0.1660 0.6950
313.15 0.0270 0.0040 0.2260 0.6040
313.15 0.0290 0.0040 0.2750 0.5130
313.15 0.0330 0.0050 0.3080 0.4430
293.15 0.0130 0.0030 0.0740 0.8420
313.15 0.0360 0.0050 0.3320 0.3870
313.15 0.0380 0.0060 0.3560 0.3390
313.15 0.0410 0.0060 0.3710 0.2940
313.15 0.0450 0.0060 0.3810 0.2180
313.15 0.0510 0.0060 0.3670 0.1490
313.15 0.0650 0.0070 0.3180 0.0790
313.15 0.0880 0.0070 0.2700 0.0500
333.15 0.0000 0.0030 0.0000 0.9110
333.15 0.0090 0.0030 0.0790 0.8070
333.15 0.0150 0.0040 0.1660 0.6820
293.15 0.0220 0.0030 0.1660 0.7130
333.15 0.0200 0.0050 0.2250 0.5890
333.15 0.0270 0.0060 0.2720 0.5030
333.15 0.0300 0.0060 0.3050 0.4350
333.15 0.0330 0.0060 0.3290 0.3810
333.15 0.0370 0.0070 0.3510 0.3300
333.15 0.0400 0.0070 0.3620 0.2860
333.15 0.0440 0.0070 0.3700 0.2120
333.15 0.0480 0.0080 0.3540 0.1480
333.15 0.0650 0.0080 0.2950 0.0730
333.15 0.0940 0.0080 0.2130 0.0330
293.15 0.0310 0.0030 0.2300 0.6190
293.15 0.0350 0.0030 0.2740 0.5350
293.15 0.0380 0.0040 0.3120 0.4580
293.15 0.0410 0.0040 0.3360 0.4070
293.15 0.0440 0.0040 0.3600 0.3560
293.15 0.0460 0.0040 0.3770 0.3070

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Water (3) - Liquid mixture 1 Mole fraction of 1-Propanol (1) - Liquid mixture 1 Mole fraction of Water (3) - Liquid mixture 2 Mole fraction of 1-Propanol (1) - Liquid mixture 2
0.1343 0.1766 0.9998 0.0000
0.1900 0.2600 0.9795 0.0200
0.2585 0.3435 0.9544 0.0446
0.2745 0.3489 0.9521 0.0465
0.3890 0.3745 0.9097 0.0865
0.4695 0.3573 0.8186 0.1650
0.5168 0.3610 0.7182 0.2463
0.5662 0.3409 0.6307 0.3053

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mole fraction of 1-Propanol (1) - Liquid mixture 1 Mole fraction of Propanoic acid, propyl ester (2) - Liquid mixture 1 Mole fraction of 1-Propanol (1) - Liquid mixture 2 Mole fraction of Propanoic acid, propyl ester (2) - Liquid mixture 2
293.15 0.0000 0.0010 0.0000 0.9410
293.15 0.0520 0.0050 0.3890 0.2290
293.15 0.0530 0.0050 0.3850 0.1920
293.15 0.0560 0.0050 0.3770 0.1540
293.15 0.0680 0.0050 0.3300 0.0860
313.15 0.0000 0.0020 0.0000 0.9260
313.15 0.0100 0.0030 0.0790 0.8200
313.15 0.0170 0.0030 0.1660 0.6950
313.15 0.0270 0.0040 0.2260 0.6040
313.15 0.0290 0.0040 0.2750 0.5130
313.15 0.0330 0.0050 0.3080 0.4430
293.15 0.0130 0.0030 0.0740 0.8420
313.15 0.0360 0.0050 0.3320 0.3870
313.15 0.0380 0.0060 0.3560 0.3390
313.15 0.0410 0.0060 0.3710 0.2940
313.15 0.0450 0.0060 0.3810 0.2180
313.15 0.0510 0.0060 0.3670 0.1490
313.15 0.0650 0.0070 0.3180 0.0790
313.15 0.0880 0.0070 0.2700 0.0500
333.15 0.0000 0.0030 0.0000 0.9110
333.15 0.0090 0.0030 0.0790 0.8070
333.15 0.0150 0.0040 0.1660 0.6820
293.15 0.0220 0.0030 0.1660 0.7130
333.15 0.0200 0.0050 0.2250 0.5890
333.15 0.0270 0.0060 0.2720 0.5030
333.15 0.0300 0.0060 0.3050 0.4350
333.15 0.0330 0.0060 0.3290 0.3810
333.15 0.0370 0.0070 0.3510 0.3300
333.15 0.0400 0.0070 0.3620 0.2860
333.15 0.0440 0.0070 0.3700 0.2120
333.15 0.0480 0.0080 0.3540 0.1480
333.15 0.0650 0.0080 0.2950 0.0730
333.15 0.0940 0.0080 0.2130 0.0330
293.15 0.0310 0.0030 0.2300 0.6190
293.15 0.0350 0.0030 0.2740 0.5350
293.15 0.0380 0.0040 0.3120 0.4580
293.15 0.0410 0.0040 0.3360 0.4070
293.15 0.0440 0.0040 0.3600 0.3560
293.15 0.0460 0.0040 0.3770 0.3070

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Water (3) - Liquid mixture 1 Mole fraction of 1-Propanol (1) - Liquid mixture 1 Mole fraction of Water (3) - Liquid mixture 2 Mole fraction of 1-Propanol (1) - Liquid mixture 2
0.1343 0.1766 0.9998 0.0000
0.1900 0.2600 0.9795 0.0200
0.2585 0.3435 0.9544 0.0446
0.2745 0.3489 0.9521 0.0465
0.3890 0.3745 0.9097 0.0865
0.4695 0.3573 0.8186 0.1650
0.5168 0.3610 0.7182 0.2463
0.5662 0.3409 0.6307 0.3053

Sources