Chemical Properties of Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl propyl ester

Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl propyl ester

InChI
InChI=1S/C18H28O4/c1-6-12-21-17(19)8-7-9-18(20)22-16(13-15(4)5)11-10-14(2)3/h15-16H,2,6-9,12-13H2,1,3-5H3
InChI Key
MNAOAXLWKTYAQF-UHFFFAOYSA-N
Formula
C18H28O4
SMILES
C=C(C)C#CC(CC(C)C)OC(=O)CCCC(=O)OCCC
Molecular Weight1
308.41
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Physical Properties

Property Value Unit Source
ΔfH°gas -661.24 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 41.44 kJ/mol Joback Calculated Property
ΔvapH° 84.36 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.647 Crippen Calculated Property
McVol 266.460 ml/mol McGowan Calculated Property
Inp 1990.00 NIST
Tboil 571.64 K Relay (1.0) Calculated Property
Tfus 264.85 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, 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 [776.81; 862.51] J/mol×K [768.50; 965.12] Show Hide
Cp,gas 776.81 J/mol×K 768.50 Joback Calculated Property
Cp,gas 793.51 J/mol×K 801.27 Joback Calculated Property
Cp,gas 809.23 J/mol×K 834.04 Joback Calculated Property
Cp,gas 823.98 J/mol×K 866.81 Joback Calculated Property
Cp,gas 837.76 J/mol×K 899.58 Joback Calculated Property
Cp,gas 850.60 J/mol×K 932.35 Joback Calculated Property
Cp,gas 862.51 J/mol×K 965.12 Joback Calculated Property

Similar Compounds

Glutaric acid, butyl 2,7-dimethyloct-5-yn-7-en-4-yl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl pentyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl isobutyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl isohexyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl heptyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl hexyl ester. Glutaric acid, decyl 2,7-dimethyloct-5-yn-7-en-4-yl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl tetradecyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl hexadecyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl pentadecyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl heptadecyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl dodecyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl octyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl nonyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl tridecyl ester.

Find more compounds similar to Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl propyl ester.

Sources

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