Chemical Properties of Glutaric acid, 3-methylbutyl tridec-2-yn-1-yl ester

Glutaric acid, 3-methylbutyl tridec-2-yn-1-yl ester

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InChI
InChI=1S/C23H40O4/c1-4-5-6-7-8-9-10-11-12-13-14-19-26-22(24)16-15-17-23(25)27-20-18-21(2)3/h21H,4-12,15-20H2,1-3H3
InChI Key
JANKHBOOFSPMDY-UHFFFAOYSA-N
Formula
C23H40O4
SMILES
CCCCCCCCCCC#CCOC(=O)CCCC(=O)OCCC(C)C
Molecular Weight1
380.56
Sources

Physical Properties

Property Value Unit Source
Δf -124.70 kJ/mol Joback Calculated Property
Δfgas -740.63 kJ/mol Joback Calculated Property
Δfus 60.50 kJ/mol Joback Calculated Property
Δvap 86.87 kJ/mol Joback Calculated Property
logPoct/wat 5.82 Crippen Calculated Property
Pc 997.65 kPa Joback Calculated Property
Tboil 886.78 K Joback Calculated Property
Tc 1086.62 K Joback Calculated Property
Tfus 584.39 K Joback Calculated Property
Vc 1.33 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1102.99 J/mol×K 886.78 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH3 3
#C- 2
-CH2- 15
>C=O (nonring) 2

Similar Compounds

Glutaric acid, tridec-2-yn-1-yl 3-methyl-5-methoxypentyl ester. Glutaric acid, butyl tridec-2-ynyl ester. Glutaric acid, pentyl tridec-2-ynyl ester. Glutaric acid, propyl tridec-2-ynyl ester. Glutaric acid, isohexyl tridec-2-ynyl ester. Glutaric acid, hexyl tridec-2-ynyl ester. Glutaric acid, di(tridec-2-ynyl) ester. Glutaric acid, ethyl tridec-2-ynyl ester. Glutaric acid, heptyl tridec-2-ynyl ester. Glutaric acid, tridec-2-yn-1-yl dodecyl ester. Glutaric acid, nonyl tridec-2-ynyl ester. Glutaric acid, isobutyl tridec-2-ynyl ester. Glutaric acid, tridec-2-yn-1-yl 2-methylbutyl ester. Glutaric acid, tridec-2-yn-1-yl 3,7-dimethyloctyl ester. Glutaric acid, tridec-2-yn-1-yl 2-ethylbutyl ester.

Find more compounds similar to Glutaric acid, 3-methylbutyl tridec-2-yn-1-yl ester.

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