Chemical Properties of Glutaric acid, (cyclohex-3-enyl)methyl but-3-yn-2-yl ester

Glutaric acid, (cyclohex-3-enyl)methyl but-3-yn-2-yl ester

InChI
InChI=1S/C16H22O4/c1-3-13(2)20-16(18)11-7-10-15(17)19-12-14-8-5-4-6-9-14/h1,4-5,13-14H,6-12H2,2H3
InChI Key
QOVYIWVTBVQXSH-UHFFFAOYSA-N
Formula
C16H22O4
SMILES
C#CC(C)OC(=O)CCCC(=O)OCC1CC=CCC1
Molecular Weight1
278.34
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Physical Properties

Property Value Unit Source
Δfus 38.44 kJ/mol Joback Calculated Property
logPoct/wat 2.621 Crippen Calculated Property
McVol 227.420 ml/mol McGowan Calculated Property
Inp [1962.00; 1962.00]   Show Hide
Inp 1962.00 NIST
Inp 1962.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [641.09; 728.96] J/mol×K [690.51; 897.05] Show Hide
Cp,gas 641.09 J/mol×K 690.51 Joback Calculated Property
Cp,gas 658.70 J/mol×K 724.93 Joback Calculated Property
Cp,gas 675.10 J/mol×K 759.36 Joback Calculated Property
Cp,gas 690.30 J/mol×K 793.78 Joback Calculated Property
Cp,gas 704.32 J/mol×K 828.20 Joback Calculated Property
Cp,gas 717.20 J/mol×K 862.62 Joback Calculated Property
Cp,gas 728.96 J/mol×K 897.05 Joback Calculated Property

Similar Compounds

Glutaric acid, (cyclohex-3-enyl)methyl 3-methylbut-2-yl ester. Glutaric acid, (cyclohex-3-enyl)methyl 1,1,1-trifluoroprop-2-yl ester. Glutaric acid, (cyclohex-3-enyl)methyl hept-2-yl ester. Glutaric acid, di((cyclohex-3-enyl)methyl) ester. Glutaric acid, (cyclohex-3-enyl)methyl dec-2-yl ester. Glutaric acid, (cyclohex-3-enyl)methyl cyclohexylmethyl ester. Glutaric acid, (cyclohex-3-enyl)methyl 2-methylpent-3-yl ester. Glutaric acid, (cyclohex-3-enyl)methyl 3-methylbut-2-en-1-yl ester. Glutaric acid, (cyclohex-3-enyl)methyl 8-chlorooctyl ester. Glutaric acid, (cyclohex-3-enyl)methyl 2,2,3,3-tetrafluoropropyl ester. Glutaric acid, 1-(cyclohex-2-enyl)hex-3-yl cyclohexylmethyl ester. Glutaric acid, 1-(cyclohex-2-enyl)hex-3-yl 2-ethylhexyl ester. Glutaric acid, hex-4-en-1-yl cyclohexylmethyl ester. Glutaric acid, hex-4-en-1-yl 2-ethylhexyl ester. 1,2-Cyclohexanedicarboxylic acid, butyl cyclohex-3-enylmethyl ester.

Find more compounds similar to Glutaric acid, (cyclohex-3-enyl)methyl but-3-yn-2-yl ester.

Sources

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