Chemical Properties of Glutaric acid, but-3-yn-2-yl trans-4-tert-butylcyclohexyl ester

Glutaric acid, but-3-yn-2-yl trans-4-tert-butylcyclohexyl ester

InChI
InChI=1S/C19H30O4/c1-6-14(2)22-17(20)8-7-9-18(21)23-16-12-10-15(11-13-16)19(3,4)5/h1,14-16H,7-13H2,2-5H3
InChI Key
WIVCEQKUHPDBPG-UHFFFAOYSA-N
Formula
C19H30O4
SMILES
C#CC(C)OC(=O)CCCC(=O)OC1CCC(C(C)(C)C)CC1
Molecular Weight1
322.44
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Physical Properties

Property Value Unit Source
Δfus 38.65 kJ/mol Joback Calculated Property
logPoct/wat 3.870 Crippen Calculated Property
McVol 273.990 ml/mol McGowan Calculated Property
Inp [2176.00; 2176.00]   Show Hide
Inp 2176.00 NIST
Inp 2176.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [840.53; 938.19] J/mol×K [752.09; 959.24] Show Hide
Cp,gas 840.53 J/mol×K 752.09 Joback Calculated Property
Cp,gas 860.31 J/mol×K 786.62 Joback Calculated Property
Cp,gas 878.63 J/mol×K 821.14 Joback Calculated Property
Cp,gas 895.54 J/mol×K 855.67 Joback Calculated Property
Cp,gas 911.07 J/mol×K 890.19 Joback Calculated Property
Cp,gas 925.27 J/mol×K 924.72 Joback Calculated Property
Cp,gas 938.19 J/mol×K 959.24 Joback Calculated Property

Similar Compounds

Glutaric acid, but-3-yn-2-yl cis-4-tert-butylcyclohexyl ester. Glutaric acid, 3,4-dimethylcyclohexyl but-3-yn-2-yl ester. Glutaric acid, hept-2-yl trans-4-tert-butylcyclohexyl ester. Glutaric acid, di(cis-4-tert-butylcyclohexyl) ester. Glutaric acid, cis-4-tert-butylcyclohexyl trans-4-tert-butylcyclohexyl ester. Glutaric acid, di(trans-4-tert-butylcyclohexyl) ester. Glutaric acid, but-3-yn-2-yl 2-ethylcyclohexyl ester. Glutaric acid, 3-methylbut-2-yl cis-4-tert-butylcyclohexyl ester. Succinic acid, but-3-yn-2-yl cis-4-methylcyclohexyl ester. Glutaric acid, 2-norbornyl but-3-yn-2-yl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl trans-4-tert-butylcyclohexyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl cis-4-tert-butylcyclohexyl ester. Glutaric acid, 2-methylpent-3-yl cis-4-tert-butylcyclohexyl ester. Glutaric acid, 2-methylpent-3-yl trans-4-tert-butylcyclohexyl ester. Glutaric acid, 1-cyclopentylethyl but-3-yn-2-yl ester.

Find more compounds similar to Glutaric acid, but-3-yn-2-yl trans-4-tert-butylcyclohexyl ester.

Sources

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