Chemical Properties of Glutaric acid, but-3-yn-2-yl 3-methylbut-2-yl ester

Glutaric acid, but-3-yn-2-yl 3-methylbut-2-yl ester

InChI
InChI=1S/C14H22O4/c1-6-11(4)17-13(15)8-7-9-14(16)18-12(5)10(2)3/h1,10-12H,7-9H2,2-5H3
InChI Key
HLHYRIJFXWQJPJ-UHFFFAOYSA-N
Formula
C14H22O4
SMILES
C#CC(C)OC(=O)CCCC(=O)OC(C)C(C)C
Molecular Weight1
254.32
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Physical Properties

Property Value Unit Source
ΔfH°gas -720.01 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 30.00 kJ/mol Joback Calculated Property
ΔvapH° 75.71 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.309 Crippen Calculated Property
McVol 214.400 ml/mol McGowan Calculated Property
Inp [1562.00; 1562.00]   Show Hide
Inp 1562.00 NIST
Inp 1562.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [576.87; 657.64] J/mol×K [661.10; 853.68] Show Hide
Cp,gas 576.87 J/mol×K 661.10 Joback Calculated Property
Cp,gas 592.31 J/mol×K 693.20 Joback Calculated Property
Cp,gas 606.96 J/mol×K 725.29 Joback Calculated Property
Cp,gas 620.80 J/mol×K 757.39 Joback Calculated Property
Cp,gas 633.86 J/mol×K 789.49 Joback Calculated Property
Cp,gas 646.13 J/mol×K 821.58 Joback Calculated Property
Cp,gas 657.64 J/mol×K 853.68 Joback Calculated Property

Similar Compounds

Glutaric acid, but-3-yn-2-yl 2,4-dimethylpent-3-yl ester. Glutaric acid, but-3-yn-2-yl 2-methylpent-3-yl ester. Glutaric acid, di(3-methylbut-2-yl) ester. Glutaric acid, 3-methylbut-2-yl isopropyl ester. Glutaric acid, hex-4-yn-3-yl 3-methylbut-2-yl ester. Succinic acid, but-3-yn-2-yl 3-methylbut-2-yl ester. Glutaric acid, ethyl 3-methylbut-2-yl ester. Glutaric acid, but-3-yn-2-yl 2-methylhex-3-yl ester. Glutaric acid, isobutyl 3-methylbut-2-yl ester. Glutaric acid, 3-methylbut-2-yl 2-pentyl ester. Glutaric acid, 3-methylbut-2-yl 2-fluoroethyl ester. Glutaric acid, 3-methylbut-2-yl propyl ester. Sebacic acid, di(3-methylbut-2-yl) ester. Glutaric acid, but-3-yn-2-yl 2-methylbutyl ester. Glutaric acid, 3-methylbut-2-yl neopentyl ester.

Find more compounds similar to Glutaric acid, but-3-yn-2-yl 3-methylbut-2-yl ester.

Sources

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