Mixture of Pentanoic acid, ethyl ester + Formic acid + Water

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Pentanoic acid, ethyl ester

Name
Pentanoic acid, ethyl ester
InChI
InChI=1S/C7H14O2/c1-3-5-6-7(8)9-4-2/h3-6H2,1-2H3
InChI Key
ICMAFTSLXCXHRK-UHFFFAOYSA-N
Formula
C7H14O2
SMILES
CCCCC(=O)OCC
Mol. Weight (g/mol)
130.18
CAS
539-82-2

Formic acid

Name
Formic acid
InChI
InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)
InChI Key
BDAGIHXWWSANSR-UHFFFAOYSA-N
Formula
CH2O2
SMILES
O=CO
Mol. Weight (g/mol)
46.03
CAS
64-18-6

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. Mole fraction (2)

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Formic acid (2) - Liquid mixture 2 Mole fraction of Pentanoic acid, ethyl ester (1) - Liquid mixture 2 Mole fraction of Pentanoic acid, ethyl ester (1) - Liquid mixture 1 Mole fraction of Formic acid (2) - Liquid mixture 1
0.0000 0.9116 0.0008 0.0000
0.0656 0.7604 0.0030 0.0705
0.1336 0.6889 0.0049 0.1505
0.2094 0.5836 0.0067 0.2342
0.2943 0.4821 0.0089 0.3056
0.3811 0.3535 0.0165 0.4095

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Formic acid (2) - Liquid mixture 2 Mole fraction of Pentanoic acid, ethyl ester (1) - Liquid mixture 2 Mole fraction of Pentanoic acid, ethyl ester (1) - Liquid mixture 1 Mole fraction of Formic acid (2) - Liquid mixture 1
0.0000 0.9116 0.0008 0.0000
0.0656 0.7604 0.0030 0.0705
0.1336 0.6889 0.0049 0.1505
0.2094 0.5836 0.0067 0.2342
0.2943 0.4821 0.0089 0.3056
0.3811 0.3535 0.0165 0.4095

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