Mixture of Acetonitrile + 1-Octanol

Excel

Acetonitrile

Name
Acetonitrile
InChI
InChI=1S/C2H3N/c1-2-3/h1H3
InChI Key
WEVYAHXRMPXWCK-UHFFFAOYSA-N
Formula
C2H3N
SMILES
CC#N
Mol. Weight (g/mol)
41.05
CAS
75-05-8

1-Octanol

Name
1-Octanol
InChI
InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3
InChI Key
KBPLFHHGFOOTCA-UHFFFAOYSA-N
Formula
C8H18O
SMILES
CCCCCCCCO
Mol. Weight (g/mol)
130.23
CAS
111-87-5
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. Excess molar enthalpy (molar enthalpy (2)
  2. Quadruple (quintuple) point temperature, K (4)
  3. Tfus - Solid-liquid equilibrium temperature, K (2)

Excess molar enthalpy (molar enthalpy of mixing), kJ/mol [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Mole fraction of 1-Octanol (2) - Liquid Excess molar enthalpy (molar enthalpy of mixing), kJ/mol - Liquid
298.15 0.0476 0.6750
298.15 0.0971 1.18
298.15 0.1479 1.57
298.15 0.1998 1.878
298.15 0.2521 2.101
298.15 0.3044 2.263
298.15 0.3562 2.37
298.15 0.4070 2.425
298.15 0.4710 2.439
298.15 0.5316 2.366
298.15 0.5882 2.255
298.15 0.6879 1.922
298.15 0.7685 1.542
298.15 0.8020 1.371
298.15 0.8567 1.026
298.15 0.8975 0.7380
298.15 0.9375 0.4910
313.15 0.0630 0.8590
313.15 0.1288 1.51
313.15 0.1966 2.039
313.15 0.2652 2.376
313.15 0.3335 2.57
313.15 0.4003 2.655
313.15 0.4647 2.656
313.15 0.5259 2.596
313.15 0.5830 2.478
313.15 0.6357 2.304
313.15 0.6837 2.095
313.15 0.7268 1.891
313.15 0.7653 1.691
313.15 0.7992 1.501
313.15 0.8288 1.32
313.15 0.8762 0.9870
313.15 0.9349 0.5170
323.15 0.0633 0.9120
323.15 0.1295 1.663
323.15 0.1975 2.262
323.15 0.2663 2.563
323.15 0.3347 2.742
323.15 0.4017 2.81
323.15 0.4661 2.801
323.15 0.5273 2.724
323.15 0.5844 2.59
323.15 0.6370 2.406
323.15 0.6849 2.212
323.15 0.7279 2.002
323.15 0.7663 1.791
323.15 0.8001 1.602
323.15 0.8296 1.402
323.15 0.8768 1.037
323.15 0.9352 0.5490

Excess molar enthalpy (molar enthalpy of mixing), kJ/mol [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Mole fraction of 1-Octanol (2) - Liquid Excess molar enthalpy (molar enthalpy of mixing), kJ/mol - Liquid
298.15 0.0476 0.6750
298.15 0.0971 1.18
298.15 0.1479 1.57
298.15 0.1998 1.878
298.15 0.2521 2.101
298.15 0.3044 2.263
298.15 0.3562 2.37
298.15 0.4070 2.425
298.15 0.4710 2.439
298.15 0.5316 2.366
298.15 0.5882 2.255
298.15 0.6879 1.922
298.15 0.7685 1.542
298.15 0.8020 1.371
298.15 0.8567 1.026
298.15 0.8975 0.7380
298.15 0.9375 0.4910
313.15 0.0630 0.8590
313.15 0.1288 1.51
313.15 0.1966 2.039
313.15 0.2652 2.376
313.15 0.3335 2.57
313.15 0.4003 2.655
313.15 0.4647 2.656
313.15 0.5259 2.596
313.15 0.5830 2.478
313.15 0.6357 2.304
313.15 0.6837 2.095
313.15 0.7268 1.891
313.15 0.7653 1.691
313.15 0.7992 1.501
313.15 0.8288 1.32
313.15 0.8762 0.9870
313.15 0.9349 0.5170
323.15 0.0633 0.9120
323.15 0.1295 1.663
323.15 0.1975 2.262
323.15 0.2663 2.563
323.15 0.3347 2.742
323.15 0.4017 2.81
323.15 0.4661 2.801
323.15 0.5273 2.724
323.15 0.5844 2.59
323.15 0.6370 2.406
323.15 0.6849 2.212
323.15 0.7279 2.002
323.15 0.7663 1.791
323.15 0.8001 1.602
323.15 0.8296 1.402
323.15 0.8768 1.037
323.15 0.9352 0.5490

Quadruple (quintuple) point temperature, K [ref]

Quadruple (quintuple) point temperature, K - Liquid mixture 1
255.53

Liquid-liquid equilibrium temperature, K [ref]

Operational condition: Pressure, kPa = 101 (Liquid mixture 1)

Mole fraction of 1-Octanol (2) - Liquid mixture 1 Liquid-liquid equilibrium temperature, K - Liquid mixture 1
0.0454 262.13
0.0661 270.06
0.0847 273.89
0.1025 276.89
0.1320 278.80
0.1586 280.25
0.1966 281.31
0.2315 281.93
0.2721 282.07
0.2953 282.03
0.3315 281.83
0.3611 281.56
0.3939 281.08
0.4220 280.60
0.4680 279.59
0.4842 279.12
0.5032 278.37
0.5242 277.69
0.5593 276.33
0.5848 274.81
0.6372 272.25
0.6752 269.33
0.6983 267.62
0.7357 264.93
0.7708 260.70
0.7948 257.40

Quadruple (quintuple) point temperature, K [ref]

Quadruple (quintuple) point temperature, K - Liquid mixture 1
255.53

Liquid-liquid equilibrium temperature, K [ref]

Operational condition: Pressure, kPa = 101 (Liquid mixture 1)

Mole fraction of 1-Octanol (2) - Liquid mixture 1 Liquid-liquid equilibrium temperature, K - Liquid mixture 1
0.0454 262.13
0.0661 270.06
0.0847 273.89
0.1025 276.89
0.1320 278.80
0.1586 280.25
0.1966 281.31
0.2315 281.93
0.2721 282.07
0.2953 282.03
0.3315 281.83
0.3611 281.56
0.3939 281.08
0.4220 280.60
0.4680 279.59
0.4842 279.12
0.5032 278.37
0.5242 277.69
0.5593 276.33
0.5848 274.81
0.6372 272.25
0.6752 269.33
0.6983 267.62
0.7357 264.93
0.7708 260.70
0.7948 257.40

Solid-liquid equilibrium temperature, K [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Mole fraction of 1-Octanol (2) - Liquid Solid-liquid equilibrium temperature, K - Liquid
0.0100 246.88
0.0226 253.45
0.0324 255.34
0.0454 255.53
0.0661 255.53
0.0847 255.53
0.1025 255.53
0.1320 255.53
0.1586 255.53
0.1966 255.53
0.2315 255.53
0.2721 255.53
0.2953 255.53
0.3315 255.53
0.3611 255.53
0.3939 255.53
0.4220 255.53
0.4680 255.53
0.4842 255.53
0.5032 255.53
0.5242 255.53
0.5593 255.53
0.5848 255.53
0.6372 255.53
0.6752 255.53
0.6983 255.53
0.7357 255.53
0.7708 255.53
0.7948 255.53
0.8315 255.82
0.8733 256.02
0.9119 256.41
0.9458 256.93
0.9677 257.42
1.0000 258.03

Solid-liquid equilibrium temperature, K [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Mole fraction of 1-Octanol (2) - Liquid Solid-liquid equilibrium temperature, K - Liquid
0.0100 246.88
0.0226 253.45
0.0324 255.34
0.0454 255.53
0.0661 255.53
0.0847 255.53
0.1025 255.53
0.1320 255.53
0.1586 255.53
0.1966 255.53
0.2315 255.53
0.2721 255.53
0.2953 255.53
0.3315 255.53
0.3611 255.53
0.3939 255.53
0.4220 255.53
0.4680 255.53
0.4842 255.53
0.5032 255.53
0.5242 255.53
0.5593 255.53
0.5848 255.53
0.6372 255.53
0.6752 255.53
0.6983 255.53
0.7357 255.53
0.7708 255.53
0.7948 255.53
0.8315 255.82
0.8733 256.02
0.9119 256.41
0.9458 256.93
0.9677 257.42
1.0000 258.03

Sources