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

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

InChI
InChI=1S/C16H24O4/c1-3-13(2)20-16(18)11-7-10-15(17)19-12-14-8-5-4-6-9-14/h1,13-14H,4-12H2,2H3
InChI Key
KKZPHWTYLLKRPI-UHFFFAOYSA-N
Formula
C16H24O4
SMILES
C#CC(C)OC(=O)CCCC(=O)OCC1CCCCC1
Molecular Weight1
280.36
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Physical Properties

Property Value Unit Source
Δfus 37.22 kJ/mol Joback Calculated Property
logPoct/wat 2.845 Crippen Calculated Property
McVol 231.720 ml/mol McGowan Calculated Property
Inp [1933.00; 1933.00]   Show Hide
Inp 1933.00 NIST
Inp 1933.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [665.00; 757.89] J/mol×K [691.35; 896.33] Show Hide
Cp,gas 665.00 J/mol×K 691.35 Joback Calculated Property
Cp,gas 683.54 J/mol×K 725.51 Joback Calculated Property
Cp,gas 700.82 J/mol×K 759.68 Joback Calculated Property
Cp,gas 716.88 J/mol×K 793.84 Joback Calculated Property
Cp,gas 731.73 J/mol×K 828.01 Joback Calculated Property
Cp,gas 745.39 J/mol×K 862.17 Joback Calculated Property
Cp,gas 757.89 J/mol×K 896.33 Joback Calculated Property

Similar Compounds

Glutaric acid, 2-ethylhexyl but-3-yn-2-yl ester. Glutaric acid, but-3-yn-2-yl 2-methylpentyl ester. Glutaric acid, but-3-yn-2-yl 2-ethylbutyl ester. Glutaric acid, cyclohexylmethyl isopropyl ester. Glutaric acid, but-3-yn-2-yl 2,4,4-trimethylpentyl ester. Glutaric acid, 2-ethylhexyl isopropyl ester. Glutaric acid, 2-(cyclohexyl)ethyl but-3-yn-2-yl ester. Glutaric acid, but-3-yn-2-yl 3,7-dimethyloctyl ester. Succinic acid, but-3-yn-2-yl 2-methylpentyl ester. Glutaric acid, cyclohexylmethyl hex-4-yn-3-yl ester. Glutaric acid, cyclohexylmethyl 2-pentyl ester. Glutaric acid, but-3-yn-2-yl 2-methylbutyl ester. Glutaric acid, cyclohexylmethyl 3-methylbut-2-yl ester. Glutaric acid, cyclohexylmethyl 2-hexyl ester. Glutaric acid, hex-4-yn-3-yl 2-ethylhexyl ester.

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

Sources

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