Chemical Properties of Glutaric acid, but-3-yn-2-yl 4-acetylphenyl ester

Glutaric acid, but-3-yn-2-yl 4-acetylphenyl ester

InChI
InChI=1S/C17H18O5/c1-4-12(2)21-16(19)6-5-7-17(20)22-15-10-8-14(9-11-15)13(3)18/h1,8-12H,5-7H2,2-3H3
InChI Key
ONYJGXNTHYXRIG-UHFFFAOYSA-N
Formula
C17H18O5
SMILES
C#CC(C)OC(=O)CCCC(=O)Oc1ccc(C(C)=O)cc1
Molecular Weight1
302.32
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Physical Properties

Property Value Unit Source
Δfus 43.23 kJ/mol Joback Calculated Property
logPoct/wat 2.530 Crippen Calculated Property
McVol 234.480 ml/mol McGowan Calculated Property
Inp [2316.00; 2316.00]   Show Hide
Inp 2316.00 NIST
Inp 2316.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [658.59; 721.90] J/mol×K [780.21; 995.06] Show Hide
Cp,gas 658.59 J/mol×K 780.21 Joback Calculated Property
Cp,gas 671.92 J/mol×K 816.02 Joback Calculated Property
Cp,gas 684.10 J/mol×K 851.83 Joback Calculated Property
Cp,gas 695.17 J/mol×K 887.64 Joback Calculated Property
Cp,gas 705.14 J/mol×K 923.44 Joback Calculated Property
Cp,gas 714.04 J/mol×K 959.25 Joback Calculated Property
Cp,gas 721.90 J/mol×K 995.06 Joback Calculated Property

Similar Compounds

Glutaric acid, 1,1,1-trifluoroprop-2-yl 4-acetylphenyl ester. Glutaric acid, 4-acetylphenyl ethyl ester. Glutaric acid, hex-4-yn-3-yl 4-acetylphenyl ester. Glutaric acid, 4-acetylphenyl propyl ester. Glutaric acid, 4-acetylphenyl butyl ester. Glutaric acid, 4-acetylphenyl isobutyl ester. Glutaric acid, 3-methylbut-2-yl 4-acetylphenyl ester. Glutaric acid, 4-acetylphenyl pentyl ester. Glutaric acid, 4-acetylphenyl hexyl ester. Glutaric acid, 4-acetylphenyl heptyl ester. Glutaric acid, 4-acetylphenyl octyl ester. Glutaric acid, 4-acetylphenyl nonyl ester. Glutaric acid, 4-acetylphenyl undecyl ester. Glutaric acid, 4-acetylphenyl dodecyl ester. Glutaric acid, 4-acetylphenyl tetradecyl ester.

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

Sources

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