Mixture of Butanoic acid, butyl ester + Dodecane + 1-Octanol

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Butanoic acid, butyl ester

Name
Butanoic acid, butyl ester
InChI
InChI=1S/C8H16O2/c1-3-5-7-10-8(9)6-4-2/h3-7H2,1-2H3
InChI Key
XUPYJHCZDLZNFP-UHFFFAOYSA-N
Formula
C8H16O2
SMILES
CCCCOC(=O)CCC
Mol. Weight (g/mol)
144.21
CAS
109-21-7

Dodecane

Name
Dodecane
InChI
InChI=1S/C12H26/c1-3-5-7-9-11-12-10-8-6-4-2/h3-12H2,1-2H3
InChI Key
SNRUBQQJIBEYMU-UHFFFAOYSA-N
Formula
C12H26
SMILES
CCCCCCCCCCCC
Mol. Weight (g/mol)
170.33
CAS
112-40-3

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
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Datasets

  1. Excess molar enthalpy (molar enthalpy (4)
  2. Excess molar volume, m3/mol (2)

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

Operational conditions:

Fixed Measured
Mole fraction of Butanoic acid, butyl ester (1) - Liquid Mole fraction of 1-Octanol (3) - Liquid Excess molar enthalpy (molar enthalpy of mixing), kJ/mol - Liquid
0.0485 0.1486 0.9340
0.0720 0.2202 1.078
0.0767 0.2349 1.113
0.1004 0.3073 1.212
0.1039 0.3180 1.213
0.1226 0.3752 1.289
0.1309 0.4007 1.294
0.1542 0.1554 1.264
0.1574 0.4818 1.348
0.1731 0.5298 1.353
0.1786 0.5466 1.347
0.1921 0.1935 1.412
0.1950 0.5966 1.32
0.2025 0.6198 1.309
0.2094 0.6409 1.287
0.2157 0.2173 1.487
0.2203 0.6743 1.246
0.2331 0.2349 1.523
0.2368 0.7247 1.178
0.2594 0.2617 1.589
0.2753 0.2774 1.638
0.3209 0.3233 1.707
0.3452 0.3479 1.739
0.3526 0.1191 1.514
0.3651 0.3679 1.748
0.3790 0.1280 1.555
0.3901 0.3930 1.752
0.4108 0.1387 1.588
0.4109 0.4140 1.757
0.4243 0.4276 1.732
0.4468 0.4502 1.716
0.4662 0.4697 1.678
0.4782 0.4818 1.655
0.4800 0.1621 1.699
0.5106 0.1724 1.716
0.5529 0.1867 1.737
0.5701 0.1925 1.73
0.6208 0.2096 1.695
0.6259 0.2114 1.699
0.6659 0.2249 1.626

Molar enthalpy of mixing with solvent, kJ/mol of Dodecane (2) [ref]

Operational conditions:

Fixed Measured
Mole fraction of Butanoic acid, butyl ester (1) - Liquid Mole fraction of 1-Octanol (3) - Liquid Molar enthalpy of mixing with solvent, kJ/mol of Dodecane (2) - Liquid
0.0485 0.1486 0.7120
0.0720 0.2202 0.7490
0.0767 0.2349 0.7620
0.1004 0.3073 0.7520
0.1039 0.3180 0.7380
0.1226 0.3752 0.7280
0.1309 0.4007 0.6950
0.1542 0.1554 0.7660
0.1574 0.4818 0.6280
0.1731 0.5298 0.5610
0.1786 0.5466 0.5310
0.1921 0.1935 0.7920
0.1950 0.5966 0.4290
0.2025 0.6198 0.3830
0.2094 0.6409 0.3290
0.2157 0.2173 0.7910
0.2203 0.6743 0.2390
0.2331 0.2349 0.7710
0.2368 0.7247 0.0950
0.2594 0.2617 0.7520
0.2753 0.2774 0.7490
0.3209 0.3233 0.6710
0.3452 0.3479 0.6250
0.3526 0.1191 0.8600
0.3651 0.3679 0.5700
0.3790 0.1280 0.8510
0.3901 0.3930 0.4930
0.4108 0.1387 0.8250
0.4109 0.4140 0.4300
0.4243 0.4276 0.3620
0.4468 0.4502 0.2740
0.4662 0.4697 0.1730
0.4782 0.4818 0.1120
0.4800 0.1621 0.8080
0.5106 0.1724 0.7680
0.5529 0.1867 0.7110
0.5701 0.1925 0.6720
0.6208 0.2096 0.5430
0.6259 0.2114 0.5380
0.6659 0.2249 0.3910

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

Operational conditions:

Fixed Measured
Mole fraction of Butanoic acid, butyl ester (1) - Liquid Mole fraction of 1-Octanol (3) - Liquid Excess molar enthalpy (molar enthalpy of mixing), kJ/mol - Liquid
0.0485 0.1486 0.9340
0.0720 0.2202 1.078
0.0767 0.2349 1.113
0.1004 0.3073 1.212
0.1039 0.3180 1.213
0.1226 0.3752 1.289
0.1309 0.4007 1.294
0.1542 0.1554 1.264
0.1574 0.4818 1.348
0.1731 0.5298 1.353
0.1786 0.5466 1.347
0.1921 0.1935 1.412
0.1950 0.5966 1.32
0.2025 0.6198 1.309
0.2094 0.6409 1.287
0.2157 0.2173 1.487
0.2203 0.6743 1.246
0.2331 0.2349 1.523
0.2368 0.7247 1.178
0.2594 0.2617 1.589
0.2753 0.2774 1.638
0.3209 0.3233 1.707
0.3452 0.3479 1.739
0.3526 0.1191 1.514
0.3651 0.3679 1.748
0.3790 0.1280 1.555
0.3901 0.3930 1.752
0.4108 0.1387 1.588
0.4109 0.4140 1.757
0.4243 0.4276 1.732
0.4468 0.4502 1.716
0.4662 0.4697 1.678
0.4782 0.4818 1.655
0.4800 0.1621 1.699
0.5106 0.1724 1.716
0.5529 0.1867 1.737
0.5701 0.1925 1.73
0.6208 0.2096 1.695
0.6259 0.2114 1.699
0.6659 0.2249 1.626

Molar enthalpy of mixing with solvent, kJ/mol of Dodecane (2) [ref]

Operational conditions:

Fixed Measured
Mole fraction of Butanoic acid, butyl ester (1) - Liquid Mole fraction of 1-Octanol (3) - Liquid Molar enthalpy of mixing with solvent, kJ/mol of Dodecane (2) - Liquid
0.0485 0.1486 0.7120
0.0720 0.2202 0.7490
0.0767 0.2349 0.7620
0.1004 0.3073 0.7520
0.1039 0.3180 0.7380
0.1226 0.3752 0.7280
0.1309 0.4007 0.6950
0.1542 0.1554 0.7660
0.1574 0.4818 0.6280
0.1731 0.5298 0.5610
0.1786 0.5466 0.5310
0.1921 0.1935 0.7920
0.1950 0.5966 0.4290
0.2025 0.6198 0.3830
0.2094 0.6409 0.3290
0.2157 0.2173 0.7910
0.2203 0.6743 0.2390
0.2331 0.2349 0.7710
0.2368 0.7247 0.0950
0.2594 0.2617 0.7520
0.2753 0.2774 0.7490
0.3209 0.3233 0.6710
0.3452 0.3479 0.6250
0.3526 0.1191 0.8600
0.3651 0.3679 0.5700
0.3790 0.1280 0.8510
0.3901 0.3930 0.4930
0.4108 0.1387 0.8250
0.4109 0.4140 0.4300
0.4243 0.4276 0.3620
0.4468 0.4502 0.2740
0.4662 0.4697 0.1730
0.4782 0.4818 0.1120
0.4800 0.1621 0.8080
0.5106 0.1724 0.7680
0.5529 0.1867 0.7110
0.5701 0.1925 0.6720
0.6208 0.2096 0.5430
0.6259 0.2114 0.5380
0.6659 0.2249 0.3910

Excess molar volume, m3/mol [ref]

Operational conditions:

Fixed Measured
Mole fraction of Butanoic acid, butyl ester (1) - Liquid Mole fraction of 1-Octanol (3) - Liquid Excess molar volume, m3/mol - Liquid
0.0329 0.1466 2.7370e-07
0.0528 0.1407 3.1190e-07
0.0608 0.2707 3.4970e-07
0.0714 0.0216 2.4710e-07
0.0804 0.0096 2.3740e-07
0.0822 0.0915 3.4150e-07
0.0867 0.3858 3.7390e-07
0.0904 0.2409 3.9840e-07
0.0910 0.4049 3.7850e-07
0.1057 0.0602 3.6010e-07
0.1092 0.4862 3.6470e-07
0.1273 0.3393 4.4100e-07
0.1299 0.5781 3.3700e-07
0.1320 0.0400 3.8490e-07
0.1490 0.6630 2.8400e-07
0.1523 0.0182 3.9080e-07
0.1529 0.1702 4.6770e-07
0.1629 0.4343 4.2370e-07
0.1750 0.4665 4.2280e-07
0.2045 0.5451 3.8870e-07
0.2074 0.1183 5.2470e-07
0.2212 0.5895 3.4680e-07
0.2451 0.0742 5.5830e-07
0.2487 0.6627 2.8540e-07
0.2721 0.0325 5.5680e-07
0.2767 0.3080 5.4950e-07
0.3019 0.3360 5.2770e-07
0.3450 0.1044 6.3050e-07
0.3751 0.2138 6.0510e-07
0.3811 0.4243 4.4820e-07
0.4041 0.2304 5.9630e-07
0.4064 0.0485 6.4670e-07
0.4260 0.4742 3.6410e-07
0.4501 0.2566 5.6510e-07
0.4502 0.1363 6.4290e-07
0.4852 0.1469 6.2970e-07
0.5126 0.2922 4.8950e-07
0.6122 0.1853 5.0440e-07
0.6235 0.0744 5.8680e-07
0.6955 0.2105 3.6160e-07
0.7139 0.0851 4.8300e-07
0.8088 0.0965 3.1240e-07

Excess molar volume, m3/mol [ref]

Operational conditions:

Fixed Measured
Mole fraction of Butanoic acid, butyl ester (1) - Liquid Mole fraction of 1-Octanol (3) - Liquid Excess molar volume, m3/mol - Liquid
0.0329 0.1466 2.7370e-07
0.0528 0.1407 3.1190e-07
0.0608 0.2707 3.4970e-07
0.0714 0.0216 2.4710e-07
0.0804 0.0096 2.3740e-07
0.0822 0.0915 3.4150e-07
0.0867 0.3858 3.7390e-07
0.0904 0.2409 3.9840e-07
0.0910 0.4049 3.7850e-07
0.1057 0.0602 3.6010e-07
0.1092 0.4862 3.6470e-07
0.1273 0.3393 4.4100e-07
0.1299 0.5781 3.3700e-07
0.1320 0.0400 3.8490e-07
0.1490 0.6630 2.8400e-07
0.1523 0.0182 3.9080e-07
0.1529 0.1702 4.6770e-07
0.1629 0.4343 4.2370e-07
0.1750 0.4665 4.2280e-07
0.2045 0.5451 3.8870e-07
0.2074 0.1183 5.2470e-07
0.2212 0.5895 3.4680e-07
0.2451 0.0742 5.5830e-07
0.2487 0.6627 2.8540e-07
0.2721 0.0325 5.5680e-07
0.2767 0.3080 5.4950e-07
0.3019 0.3360 5.2770e-07
0.3450 0.1044 6.3050e-07
0.3751 0.2138 6.0510e-07
0.3811 0.4243 4.4820e-07
0.4041 0.2304 5.9630e-07
0.4064 0.0485 6.4670e-07
0.4260 0.4742 3.6410e-07
0.4501 0.2566 5.6510e-07
0.4502 0.1363 6.4290e-07
0.4852 0.1469 6.2970e-07
0.5126 0.2922 4.8950e-07
0.6122 0.1853 5.0440e-07
0.6235 0.0744 5.8680e-07
0.6955 0.2105 3.6160e-07
0.7139 0.0851 4.8300e-07
0.8088 0.0965 3.1240e-07

Sources