Mixture of Benzonitrile + Ethyl Acetate + Water

Excel

Benzonitrile

Name
Benzonitrile
InChI
InChI=1S/C7H5N/c8-6-7-4-2-1-3-5-7/h1-5H
InChI Key
JFDZBHWFFUWGJE-UHFFFAOYSA-N
Formula
C7H5N
SMILES
N#Cc1ccccc1
Mol. Weight (g/mol)
103.12
CAS
100-47-0

Ethyl Acetate

Name
Ethyl Acetate
InChI
InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
InChI Key
XEKOWRVHYACXOJ-UHFFFAOYSA-N
Formula
C4H8O2
SMILES
CCOC(C)=O
Mol. Weight (g/mol)
88.11
CAS
141-78-6

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 (2)

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 1)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of Ethyl Acetate (2) - Liquid mixture 1 Mole fraction of Benzonitrile (1) - Liquid mixture 1 Mole fraction of Benzonitrile (1) - Liquid mixture 2 Mole fraction of Ethyl Acetate (2) - Liquid mixture 2
298.15 0.0015 0.0010 0.8738 0.0814
298.15 0.0028 0.0009 0.7862 0.1626
298.15 0.0043 0.0008 0.6903 0.2492
298.15 0.0058 0.0007 0.6111 0.3214
298.15 0.0072 0.0006 0.5414 0.3835
298.15 0.0085 0.0005 0.4654 0.4523
298.15 0.0101 0.0004 0.3891 0.5228
298.15 0.0113 0.0004 0.3182 0.5833
298.15 0.0128 0.0003 0.2345 0.6530
298.15 0.0141 0.0002 0.1497 0.7151
303.15 0.0014 0.0013 0.8382 0.0949
303.15 0.0028 0.0012 0.7434 0.1808
303.15 0.0041 0.0010 0.6575 0.2622
303.15 0.0055 0.0009 0.5844 0.3319
303.15 0.0067 0.0007 0.5180 0.3880
303.15 0.0081 0.0006 0.4429 0.4567
303.15 0.0095 0.0005 0.3649 0.5243
303.15 0.0109 0.0004 0.2876 0.5877
303.15 0.0124 0.0003 0.2112 0.6550
303.15 0.0136 0.0002 0.1305 0.7169
308.15 0.0014 0.0016 0.8143 0.1083
308.15 0.0027 0.0014 0.7218 0.1921
308.15 0.0037 0.0013 0.6373 0.2676
308.15 0.0050 0.0011 0.5672 0.3325
308.15 0.0062 0.0009 0.4927 0.3961
308.15 0.0075 0.0008 0.4219 0.4602
308.15 0.0089 0.0006 0.3471 0.5260
308.15 0.0102 0.0005 0.2696 0.5886
308.15 0.0118 0.0004 0.1903 0.6571
308.15 0.0132 0.0002 0.1148 0.7207
313.15 0.0013 0.0020 0.7810 0.1226
313.15 0.0025 0.0018 0.6992 0.2005
313.15 0.0037 0.0016 0.6078 0.2781
313.15 0.0048 0.0013 0.5399 0.3420
313.15 0.0059 0.0012 0.4748 0.4002
313.15 0.0071 0.0010 0.3982 0.4699
313.15 0.0085 0.0008 0.3224 0.5314
313.15 0.0100 0.0006 0.2480 0.6002
313.15 0.0115 0.0004 0.1690 0.6658
313.15 0.0129 0.0002 0.0921 0.7258
318.15 0.0012 0.0024 0.7515 0.1305
318.15 0.0025 0.0022 0.6622 0.2124
318.15 0.0034 0.0019 0.5830 0.2859
318.15 0.0046 0.0017 0.5101 0.3567
318.15 0.0058 0.0014 0.4334 0.4244
318.15 0.0070 0.0012 0.3646 0.4835
318.15 0.0084 0.0009 0.2910 0.5500
318.15 0.0097 0.0007 0.2163 0.6122
318.15 0.0112 0.0005 0.1441 0.6698
318.15 0.0127 0.0002 0.0690 0.7305

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 1)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of Ethyl Acetate (2) - Liquid mixture 1 Mole fraction of Benzonitrile (1) - Liquid mixture 1 Mole fraction of Benzonitrile (1) - Liquid mixture 2 Mole fraction of Ethyl Acetate (2) - Liquid mixture 2
298.15 0.0015 0.0010 0.8738 0.0814
298.15 0.0028 0.0009 0.7862 0.1626
298.15 0.0043 0.0008 0.6903 0.2492
298.15 0.0058 0.0007 0.6111 0.3214
298.15 0.0072 0.0006 0.5414 0.3835
298.15 0.0085 0.0005 0.4654 0.4523
298.15 0.0101 0.0004 0.3891 0.5228
298.15 0.0113 0.0004 0.3182 0.5833
298.15 0.0128 0.0003 0.2345 0.6530
298.15 0.0141 0.0002 0.1497 0.7151
303.15 0.0014 0.0013 0.8382 0.0949
303.15 0.0028 0.0012 0.7434 0.1808
303.15 0.0041 0.0010 0.6575 0.2622
303.15 0.0055 0.0009 0.5844 0.3319
303.15 0.0067 0.0007 0.5180 0.3880
303.15 0.0081 0.0006 0.4429 0.4567
303.15 0.0095 0.0005 0.3649 0.5243
303.15 0.0109 0.0004 0.2876 0.5877
303.15 0.0124 0.0003 0.2112 0.6550
303.15 0.0136 0.0002 0.1305 0.7169
308.15 0.0014 0.0016 0.8143 0.1083
308.15 0.0027 0.0014 0.7218 0.1921
308.15 0.0037 0.0013 0.6373 0.2676
308.15 0.0050 0.0011 0.5672 0.3325
308.15 0.0062 0.0009 0.4927 0.3961
308.15 0.0075 0.0008 0.4219 0.4602
308.15 0.0089 0.0006 0.3471 0.5260
308.15 0.0102 0.0005 0.2696 0.5886
308.15 0.0118 0.0004 0.1903 0.6571
308.15 0.0132 0.0002 0.1148 0.7207
313.15 0.0013 0.0020 0.7810 0.1226
313.15 0.0025 0.0018 0.6992 0.2005
313.15 0.0037 0.0016 0.6078 0.2781
313.15 0.0048 0.0013 0.5399 0.3420
313.15 0.0059 0.0012 0.4748 0.4002
313.15 0.0071 0.0010 0.3982 0.4699
313.15 0.0085 0.0008 0.3224 0.5314
313.15 0.0100 0.0006 0.2480 0.6002
313.15 0.0115 0.0004 0.1690 0.6658
313.15 0.0129 0.0002 0.0921 0.7258
318.15 0.0012 0.0024 0.7515 0.1305
318.15 0.0025 0.0022 0.6622 0.2124
318.15 0.0034 0.0019 0.5830 0.2859
318.15 0.0046 0.0017 0.5101 0.3567
318.15 0.0058 0.0014 0.4334 0.4244
318.15 0.0070 0.0012 0.3646 0.4835
318.15 0.0084 0.0009 0.2910 0.5500
318.15 0.0097 0.0007 0.2163 0.6122
318.15 0.0112 0.0005 0.1441 0.6698
318.15 0.0127 0.0002 0.0690 0.7305

Sources