- Name
- 1-Butanol
- InChI
- InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3
- InChI Key
- LRHPLDYGYMQRHN-UHFFFAOYSA-N
- Formula
- C4H10O
- SMILES
- CCCCO
- Mol. Weight (g/mol)
- 74.12
- CAS
- 71-36-3
- Name
- Acetic acid, methyl ester
- InChI
- InChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3
- InChI Key
- KXKVLQRXCPHEJC-UHFFFAOYSA-N
- Formula
- C3H6O2
- SMILES
- COC(C)=O
- Mol. Weight (g/mol)
- 74.08
- CAS
- 79-20-9
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Datasets
- Mole fraction (2)
- Excess molar enthalpy (molar enthalpy (2)
- ρl - Mass density, kg/m3 (2)
- Tboil - Boiling temperature at pressure P, K (2)
Mole fraction of Acetic acid, methyl ester (2) [ref]
Operational condition: Pressure, kPa = 300 (Liquid)
| Mole fraction of Acetic acid, methyl ester (2) - Liquid | Mole fraction of Acetic acid, methyl ester (2) - Gas |
|---|---|
| 0.0000 | 0.0000 |
| 0.0090 | 0.0600 |
| 0.0240 | 0.1350 |
| 0.0790 | 0.3520 |
| 0.1050 | 0.4150 |
| 0.1270 | 0.4680 |
| 0.1310 | 0.4850 |
| 0.1660 | 0.5560 |
| 0.1940 | 0.5980 |
| 0.2290 | 0.6460 |
| 0.2650 | 0.6850 |
| 0.2840 | 0.7050 |
| 0.3410 | 0.7550 |
| 0.3460 | 0.7570 |
| 0.3540 | 0.7630 |
| 0.4120 | 0.8000 |
| 0.4490 | 0.8220 |
| 0.4670 | 0.8320 |
| 0.5090 | 0.8590 |
| 0.6130 | 0.8970 |
| 0.6430 | 0.9040 |
| 0.6800 | 0.9130 |
| 0.7110 | 0.9170 |
| 0.8350 | 0.9520 |
| 0.8630 | 0.9610 |
| 0.8980 | 0.9720 |
| 0.9410 | 0.9830 |
| 0.9710 | 0.9910 |
| 0.9880 | 0.9950 |
| 0.9940 | 0.9960 |
| 1.0000 | 1.0000 |
Mole fraction of Acetic acid, methyl ester (2) [ref]
Operational condition: Pressure, kPa = 300 (Liquid)
| Mole fraction of Acetic acid, methyl ester (2) - Liquid | Mole fraction of Acetic acid, methyl ester (2) - Gas |
|---|---|
| 0.0000 | 0.0000 |
| 0.0090 | 0.0600 |
| 0.0240 | 0.1350 |
| 0.0790 | 0.3520 |
| 0.1050 | 0.4150 |
| 0.1270 | 0.4680 |
| 0.1310 | 0.4850 |
| 0.1660 | 0.5560 |
| 0.1940 | 0.5980 |
| 0.2290 | 0.6460 |
| 0.2650 | 0.6850 |
| 0.2840 | 0.7050 |
| 0.3410 | 0.7550 |
| 0.3460 | 0.7570 |
| 0.3540 | 0.7630 |
| 0.4120 | 0.8000 |
| 0.4490 | 0.8220 |
| 0.4670 | 0.8320 |
| 0.5090 | 0.8590 |
| 0.6130 | 0.8970 |
| 0.6430 | 0.9040 |
| 0.6800 | 0.9130 |
| 0.7110 | 0.9170 |
| 0.8350 | 0.9520 |
| 0.8630 | 0.9610 |
| 0.8980 | 0.9720 |
| 0.9410 | 0.9830 |
| 0.9710 | 0.9910 |
| 0.9880 | 0.9950 |
| 0.9940 | 0.9960 |
| 1.0000 | 1.0000 |
Excess molar enthalpy (molar enthalpy of mixing), kJ/mol [ref]
| Fixed | Measured | ||
|---|---|---|---|
| Temperature, K - Liquid | Pressure, kPa - Liquid | Mole fraction of Acetic acid, methyl ester (2) - Liquid | Excess molar enthalpy (molar enthalpy of mixing), kJ/mol - Liquid |
| 298.15 | 5000.00 | 0.0500 | 0.3246 |
| 298.15 | 5000.00 | 0.1000 | 0.6068 |
| 298.15 | 5000.00 | 0.1490 | 0.8401 |
| 298.15 | 5000.00 | 0.1990 | 1.0376 |
| 298.15 | 5000.00 | 0.2490 | 1.2028 |
| 298.15 | 5000.00 | 0.3000 | 1.3376 |
| 298.15 | 5000.00 | 0.3490 | 1.4354 |
| 298.15 | 5000.00 | 0.3990 | 1.5026 |
| 298.15 | 5000.00 | 0.4500 | 1.5482 |
| 298.15 | 5000.00 | 0.5010 | 1.558 |
| 298.15 | 5000.00 | 0.5500 | 1.5407 |
| 298.15 | 5000.00 | 0.6000 | 1.5015 |
| 298.15 | 5000.00 | 0.6510 | 1.427 |
| 298.15 | 5000.00 | 0.6990 | 1.3226 |
| 298.15 | 5000.00 | 0.7510 | 1.1889 |
| 298.15 | 5000.00 | 0.8010 | 1.0214 |
| 298.15 | 5000.00 | 0.8510 | 0.8127 |
| 298.15 | 5000.00 | 0.8990 | 0.5890 |
| 298.15 | 5000.00 | 0.9510 | 0.3039 |
| 298.15 | 10000.00 | 0.0500 | 0.3222 |
| 298.15 | 10000.00 | 0.1000 | 0.6036 |
| 298.15 | 10000.00 | 0.1490 | 0.8350 |
| 298.15 | 10000.00 | 0.2010 | 1.041 |
| 298.15 | 10000.00 | 0.2510 | 1.2066 |
| 298.15 | 10000.00 | 0.3000 | 1.331 |
| 298.15 | 10000.00 | 0.3510 | 1.4339 |
| 298.15 | 10000.00 | 0.4010 | 1.5044 |
| 298.15 | 10000.00 | 0.4490 | 1.5438 |
| 298.15 | 10000.00 | 0.5000 | 1.5563 |
| 298.15 | 10000.00 | 0.5490 | 1.5409 |
| 298.15 | 10000.00 | 0.5990 | 1.4988 |
| 298.15 | 10000.00 | 0.6500 | 1.4246 |
| 298.15 | 10000.00 | 0.7010 | 1.3158 |
| 298.15 | 10000.00 | 0.7510 | 1.1879 |
| 298.15 | 10000.00 | 0.8000 | 1.0201 |
| 298.15 | 10000.00 | 0.8510 | 0.8182 |
| 298.15 | 10000.00 | 0.8990 | 0.5908 |
| 298.15 | 10000.00 | 0.9510 | 0.3037 |
| 308.15 | 10000.00 | 0.0470 | 0.3064 |
| 308.15 | 10000.00 | 0.0980 | 0.6155 |
| 308.15 | 10000.00 | 0.1460 | 0.8718 |
| 308.15 | 10000.00 | 0.1930 | 1.0771 |
| 308.15 | 10000.00 | 0.2430 | 1.2587 |
| 308.15 | 10000.00 | 0.2910 | 1.4008 |
| 308.15 | 10000.00 | 0.3430 | 1.5191 |
| 308.15 | 10000.00 | 0.3900 | 1.5964 |
| 308.15 | 10000.00 | 0.4400 | 1.651 |
| 308.15 | 10000.00 | 0.4920 | 1.6667 |
| 308.15 | 10000.00 | 0.5410 | 1.6558 |
| 308.15 | 10000.00 | 0.5910 | 1.6103 |
| 308.15 | 10000.00 | 0.6410 | 1.5424 |
| 308.15 | 10000.00 | 0.6920 | 1.4393 |
| 308.15 | 10000.00 | 0.7440 | 1.2949 |
| 308.15 | 10000.00 | 0.7940 | 1.1177 |
| 308.15 | 10000.00 | 0.8960 | 0.6596 |
| 308.15 | 10000.00 | 0.9470 | 0.3534 |
Excess molar enthalpy (molar enthalpy of mixing), kJ/mol [ref]
| Fixed | Measured | ||
|---|---|---|---|
| Temperature, K - Liquid | Pressure, kPa - Liquid | Mole fraction of Acetic acid, methyl ester (2) - Liquid | Excess molar enthalpy (molar enthalpy of mixing), kJ/mol - Liquid |
| 298.15 | 5000.00 | 0.0500 | 0.3246 |
| 298.15 | 5000.00 | 0.1000 | 0.6068 |
| 298.15 | 5000.00 | 0.1490 | 0.8401 |
| 298.15 | 5000.00 | 0.1990 | 1.0376 |
| 298.15 | 5000.00 | 0.2490 | 1.2028 |
| 298.15 | 5000.00 | 0.3000 | 1.3376 |
| 298.15 | 5000.00 | 0.3490 | 1.4354 |
| 298.15 | 5000.00 | 0.3990 | 1.5026 |
| 298.15 | 5000.00 | 0.4500 | 1.5482 |
| 298.15 | 5000.00 | 0.5010 | 1.558 |
| 298.15 | 5000.00 | 0.5500 | 1.5407 |
| 298.15 | 5000.00 | 0.6000 | 1.5015 |
| 298.15 | 5000.00 | 0.6510 | 1.427 |
| 298.15 | 5000.00 | 0.6990 | 1.3226 |
| 298.15 | 5000.00 | 0.7510 | 1.1889 |
| 298.15 | 5000.00 | 0.8010 | 1.0214 |
| 298.15 | 5000.00 | 0.8510 | 0.8127 |
| 298.15 | 5000.00 | 0.8990 | 0.5890 |
| 298.15 | 5000.00 | 0.9510 | 0.3039 |
| 298.15 | 10000.00 | 0.0500 | 0.3222 |
| 298.15 | 10000.00 | 0.1000 | 0.6036 |
| 298.15 | 10000.00 | 0.1490 | 0.8350 |
| 298.15 | 10000.00 | 0.2010 | 1.041 |
| 298.15 | 10000.00 | 0.2510 | 1.2066 |
| 298.15 | 10000.00 | 0.3000 | 1.331 |
| 298.15 | 10000.00 | 0.3510 | 1.4339 |
| 298.15 | 10000.00 | 0.4010 | 1.5044 |
| 298.15 | 10000.00 | 0.4490 | 1.5438 |
| 298.15 | 10000.00 | 0.5000 | 1.5563 |
| 298.15 | 10000.00 | 0.5490 | 1.5409 |
| 298.15 | 10000.00 | 0.5990 | 1.4988 |
| 298.15 | 10000.00 | 0.6500 | 1.4246 |
| 298.15 | 10000.00 | 0.7010 | 1.3158 |
| 298.15 | 10000.00 | 0.7510 | 1.1879 |
| 298.15 | 10000.00 | 0.8000 | 1.0201 |
| 298.15 | 10000.00 | 0.8510 | 0.8182 |
| 298.15 | 10000.00 | 0.8990 | 0.5908 |
| 298.15 | 10000.00 | 0.9510 | 0.3037 |
| 308.15 | 10000.00 | 0.0470 | 0.3064 |
| 308.15 | 10000.00 | 0.0980 | 0.6155 |
| 308.15 | 10000.00 | 0.1460 | 0.8718 |
| 308.15 | 10000.00 | 0.1930 | 1.0771 |
| 308.15 | 10000.00 | 0.2430 | 1.2587 |
| 308.15 | 10000.00 | 0.2910 | 1.4008 |
| 308.15 | 10000.00 | 0.3430 | 1.5191 |
| 308.15 | 10000.00 | 0.3900 | 1.5964 |
| 308.15 | 10000.00 | 0.4400 | 1.651 |
| 308.15 | 10000.00 | 0.4920 | 1.6667 |
| 308.15 | 10000.00 | 0.5410 | 1.6558 |
| 308.15 | 10000.00 | 0.5910 | 1.6103 |
| 308.15 | 10000.00 | 0.6410 | 1.5424 |
| 308.15 | 10000.00 | 0.6920 | 1.4393 |
| 308.15 | 10000.00 | 0.7440 | 1.2949 |
| 308.15 | 10000.00 | 0.7940 | 1.1177 |
| 308.15 | 10000.00 | 0.8960 | 0.6596 |
| 308.15 | 10000.00 | 0.9470 | 0.3534 |
Mass density, kg/m3 [ref]
Operational conditions:
- Pressure, kPa = 101 (Liquid)
- Temperature, K = 298.15 (Liquid)
| Mole fraction of Acetic acid, methyl ester (2) - Liquid | Mass density, kg/m3 - Liquid |
|---|---|
| 0.0000 | 805.9 |
| 0.0366 | 809.2 |
| 0.0844 | 813.5 |
| 0.1717 | 821.9 |
| 0.2879 | 833.8 |
| 0.3366 | 839.1 |
| 0.4050 | 846.7 |
| 0.5269 | 861.0 |
| 0.6518 | 876.7 |
| 0.7130 | 884.8 |
| 0.8445 | 903.3 |
| 0.9037 | 912.2 |
| 0.9559 | 920.2 |
| 1.0000 | 927.3 |
Mass density, kg/m3 [ref]
Operational conditions:
- Pressure, kPa = 101 (Liquid)
- Temperature, K = 298.15 (Liquid)
| Mole fraction of Acetic acid, methyl ester (2) - Liquid | Mass density, kg/m3 - Liquid |
|---|---|
| 0.0000 | 805.9 |
| 0.0366 | 809.2 |
| 0.0844 | 813.5 |
| 0.1717 | 821.9 |
| 0.2879 | 833.8 |
| 0.3366 | 839.1 |
| 0.4050 | 846.7 |
| 0.5269 | 861.0 |
| 0.6518 | 876.7 |
| 0.7130 | 884.8 |
| 0.8445 | 903.3 |
| 0.9037 | 912.2 |
| 0.9559 | 920.2 |
| 1.0000 | 927.3 |
Boiling temperature at pressure P, K [ref]
Operational condition: Pressure, kPa = 300 (Liquid)
| Mole fraction of Acetic acid, methyl ester (2) - Liquid | Boiling temperature at pressure P, K - Liquid |
|---|---|
| 0.0000 | 425.39 |
| 0.0090 | 423.84 |
| 0.0240 | 421.67 |
| 0.0790 | 413.74 |
| 0.1050 | 411.44 |
| 0.1270 | 408.88 |
| 0.1310 | 408.33 |
| 0.1660 | 404.72 |
| 0.1940 | 402.05 |
| 0.2290 | 399.25 |
| 0.2650 | 396.68 |
| 0.2840 | 395.32 |
| 0.3410 | 391.87 |
| 0.3460 | 391.74 |
| 0.3540 | 391.49 |
| 0.4120 | 388.11 |
| 0.4490 | 386.35 |
| 0.4670 | 385.38 |
| 0.5090 | 382.87 |
| 0.6130 | 378.61 |
| 0.6430 | 377.66 |
| 0.6800 | 376.56 |
| 0.7110 | 375.68 |
| 0.8350 | 371.17 |
| 0.8630 | 370.14 |
| 0.8980 | 368.79 |
| 0.9410 | 367.45 |
| 0.9710 | 366.58 |
| 0.9880 | 366.14 |
| 0.9940 | 365.88 |
| 1.0000 | 365.85 |
Boiling temperature at pressure P, K [ref]
Operational condition: Pressure, kPa = 300 (Liquid)
| Mole fraction of Acetic acid, methyl ester (2) - Liquid | Boiling temperature at pressure P, K - Liquid |
|---|---|
| 0.0000 | 425.39 |
| 0.0090 | 423.84 |
| 0.0240 | 421.67 |
| 0.0790 | 413.74 |
| 0.1050 | 411.44 |
| 0.1270 | 408.88 |
| 0.1310 | 408.33 |
| 0.1660 | 404.72 |
| 0.1940 | 402.05 |
| 0.2290 | 399.25 |
| 0.2650 | 396.68 |
| 0.2840 | 395.32 |
| 0.3410 | 391.87 |
| 0.3460 | 391.74 |
| 0.3540 | 391.49 |
| 0.4120 | 388.11 |
| 0.4490 | 386.35 |
| 0.4670 | 385.38 |
| 0.5090 | 382.87 |
| 0.6130 | 378.61 |
| 0.6430 | 377.66 |
| 0.6800 | 376.56 |
| 0.7110 | 375.68 |
| 0.8350 | 371.17 |
| 0.8630 | 370.14 |
| 0.8980 | 368.79 |
| 0.9410 | 367.45 |
| 0.9710 | 366.58 |
| 0.9880 | 366.14 |
| 0.9940 | 365.88 |
| 1.0000 | 365.85 |
Sources
- Experimental Determination of Densities and Isobaric Vapor Liquid Equilibria of Methyl Acetate and Ethyl Acetate with Alcohols (C3 and C4) at 0.3 MPa
- Excess Molar Enthalpies of Methyl Acetate and (1-Propanol, 2-Propanol, 1-Butanol, 2-Butanol, and 1-Pentanol) at T = (298.15 and 308.15) K and P = (5.0 and 10.0) MPa