Chemical Properties of Glutaric acid, decyl 2,6-dimethylnon-1-en-3-yn-5-yl ester

Glutaric acid, decyl 2,6-dimethylnon-1-en-3-yn-5-yl ester

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InChI
InChI=1S/C26H44O4/c1-6-8-9-10-11-12-13-14-21-29-25(27)17-15-18-26(28)30-24(20-19-22(3)4)23(5)16-7-2/h23-24H,3,6-18,21H2,1-2,4-5H3
InChI Key
OKPJIUHHWLPTOJ-UHFFFAOYSA-N
Formula
C26H44O4
SMILES
C=C(C)C#CC(OC(=O)CCCC(=O)OCCCCCCCCCC)C(C)CCC
Molecular Weight1
420.63
Sources

Physical Properties

Property Value Unit Source
Δf -22.59 kJ/mol Joback Calculated Property
Δfgas -692.19 kJ/mol Joback Calculated Property
Δfus 62.16 kJ/mol Joback Calculated Property
Δvap 92.57 kJ/mol Joback Calculated Property
logPoct/wat 6.77 Crippen Calculated Property
Pc 865.56 kPa Joback Calculated Property
Tboil 951.54 K Joback Calculated Property
Tc 1165.04 K Joback Calculated Property
Tfus 587.48 K Joback Calculated Property
Vc 1.47 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1261.56 J/mol×K 951.54 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 2
-CH3 4
=CH2 1
#C- 2
-CH2- 14
=C< 1
>C=O (nonring) 2

Similar Compounds

Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl dodecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl octyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl tridecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl tetradecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl pentadecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl hexadecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl undecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl nonyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl heptyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl hexyl ester. Glutaric acid, hept-2-yl 2,6-dimethylnon-1-en-3-yn-5-yl ester. Glutaric acid, 3-methylbut-2-yl 2,6-dimethylnon-1-en-3-yn-5-yl ester. Glutaric acid, di(2,6-dimethylnon-1-en-3-yn-5-yl) ester. Glutaric acid, but-3-yn-2-yl 2,6-dimethylnon-1-en-3-yn-5-yl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl pentyl ester.

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