Chemical Properties of Glutaric acid, hex-2-en-1-yl but-3-yn-2-yl ester

Glutaric acid, hex-2-en-1-yl but-3-yn-2-yl ester

InChI
InChI=1S/C15H22O4/c1-4-6-7-8-12-18-14(16)10-9-11-15(17)19-13(3)5-2/h2,7-8,13H,4,6,9-12H2,1,3H3/b8-7+
InChI Key
PTIJHXAOGWVMAU-BQYQJAHWSA-N
Formula
C15H22O4
SMILES
C#CC(C)OC(=O)CCCC(=O)OCC=CCCC
Molecular Weight1
266.33
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Physical Properties

Property Value Unit Source
ΔfusH° 39.83 kJ/mol Joback Calculated Property
logPoct/wat 2.621 Crippen Calculated Property
McVol 224.190 ml/mol McGowan Calculated Property
Inp [1748.00; 1748.00]   Show Hide
Inp 1748.00 NIST
Inp 1748.00 NIST
Tboil 555.10 K Relay (1.0) Calculated Property
Tfus 268.78 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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 [606.86; 684.65] J/mol×K [689.02; 880.20] Show Hide
Cp,gas 606.86 J/mol×K 689.02 Joback Calculated Property
Cp,gas 621.73 J/mol×K 720.88 Joback Calculated Property
Cp,gas 635.81 J/mol×K 752.75 Joback Calculated Property
Cp,gas 649.12 J/mol×K 784.61 Joback Calculated Property
Cp,gas 661.69 J/mol×K 816.47 Joback Calculated Property
Cp,gas 673.52 J/mol×K 848.33 Joback Calculated Property
Cp,gas 684.65 J/mol×K 880.20 Joback Calculated Property

Similar Compounds

Glutaric acid, but-3-yn-2-yl undec-2-enyl ester. Glutaric acid, dodec-2-en-1-yl but-3-yn-2-yl ester. Glutaric acid, pent-2-en-1-yl but-3-yn-2-yl ester. Succinic acid, but-3-yn-2-yl cis-hex-2-en-1-yl ester. Glutaric acid, but-3-yn-2-yl oct-3-en-2-yl ester. Glutaric acid, di(hex-2-en-1-yl) ester. Glutaric acid, but-3-en-2-yl dodec-2-en-1-yl ester. Glutaric acid, hex-2-en-1-yl 3-methylbut-2-en-1-yl ester. Glutaric acid, hex-2-en-1-yl dodec-2-en-1-yl ester. Glutaric acid, di(undec-2-enyl) ester. Glutaric acid, pent-2-en-1-yl dodec-2-en-1-yl ester. (Z)-2-Hexenyl pentanoate. trans-2-Hexenyl valerate. Glutaric acid, hex-2-en-1-yl 1,1,1-trifluoroprop-2-yl ester. Glutaric acid, dodec-2-en-1-yl 2-fluoroethyl ester.

Find more compounds similar to Glutaric acid, hex-2-en-1-yl but-3-yn-2-yl ester.

Sources

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