Chemical Properties of Glutaric acid, di(tridec-2-ynyl) ester

Glutaric acid, di(tridec-2-ynyl) ester

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InChI
InChI=1S/C31H52O4/c1-3-5-7-9-11-13-15-17-19-21-23-28-34-30(32)26-25-27-31(33)35-29-24-22-20-18-16-14-12-10-8-6-4-2/h3-20,25-29H2,1-2H3
InChI Key
WJYYNLNKYUALCD-UHFFFAOYSA-N
Formula
C31H52O4
SMILES
CCCCCCCCCCC#CCOC(=O)CCCC(=O)OCC#CCCCCCCCCCC
Molecular Weight1
488.74
Sources

Physical Properties

Property Value Unit Source
Δf 147.90 kJ/mol Joback Calculated Property
Δfgas -628.17 kJ/mol Joback Calculated Property
Δfus 87.86 kJ/mol Joback Calculated Property
Δvap 107.22 kJ/mol Joback Calculated Property
logPoct/wat 8.31 Crippen Calculated Property
Pc 699.13 kPa Joback Calculated Property
Tboil 1079.26 K Joback Calculated Property
Tc 1337.04 K Joback Calculated Property
Tfus 795.65 K Joback Calculated Property
Vc 1.74 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1554.42 J/mol×K 1079.26 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
#C- 4
-O- (nonring) 2
-CH2- 23
>C=O (nonring) 2
-CH3 2

Similar Compounds

Glutaric acid, ethyl tridec-2-ynyl ester. Glutaric acid, propyl tridec-2-ynyl ester. Glutaric acid, butyl tridec-2-ynyl ester. Glutaric acid, pentyl tridec-2-ynyl ester. Glutaric acid, hexyl tridec-2-ynyl ester. Valeric acid, 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, isohexyl tridec-2-ynyl ester. Glutaric acid, 3-methylbutyl tridec-2-yn-1-yl ester. Glutaric acid, tridec-2-yn-1-yl 2-fluoroethyl ester. Hexanoic acid, tridec-2-ynyl ester. Glutaric acid, tridec-2-yn-1-yl but-3-yn-2-yl ester.

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