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

Glutaric acid, but-3-yn-2-yl 2-methylbutyl ester

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InChI
InChI=1S/C14H22O4/c1-5-11(3)10-17-13(15)8-7-9-14(16)18-12(4)6-2/h2,11-12H,5,7-10H2,1,3-4H3
InChI Key
PORRBCKDNGIMGI-UHFFFAOYSA-N
Formula
C14H22O4
SMILES
C#CC(C)OC(=O)CCCC(=O)OCC(C)CC
Molecular Weight1
254.32
Sources

Physical Properties

Property Value Unit Source
Δf -182.65 kJ/mol Joback Calculated Property
Δfgas -540.55 kJ/mol Joback Calculated Property
Δfus 33.52 kJ/mol Joback Calculated Property
Δvap 64.15 kJ/mol Joback Calculated Property
logPoct/wat 2.31 Crippen Calculated Property
Pc 1880.53 kPa Joback Calculated Property
Tboil 661.54 K Joback Calculated Property
Tc 851.00 K Joback Calculated Property
Tfus 408.83 K Joback Calculated Property
Vc 0.82 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 576.39 J/mol×K 661.54 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 2
-CH3 3
#C- 1
-CH2- 5
#CH 1
>C=O (nonring) 2

Similar Compounds

Glutaric acid, but-3-yn-2-yl 2-ethylbutyl ester. Glutaric acid, but-3-yn-2-yl 2-methylpentyl ester. Glutaric acid, but-3-yn-2-yl isobutyl ester. Glutaric acid, but-3-yn-2-yl neopentyl ester. Glutaric acid, but-3-yn-2-yl 2,4,4-trimethylpentyl ester. Glutaric acid, but-3-yn-2-yl 3-methylbut-2-yl ester. Glutaric acid, but-3-yn-2-yl butyl ester. Glutaric acid, 2-ethylhexyl but-3-yn-2-yl ester. Glutaric acid, but-3-yl-2-yn 3-methylbutyl ester. Glutaric acid, but-3-yn-2-yl hexyl ester. Glutaric acid, cyclohexylmethyl but-3-yn-2-yl ester. Glutaric acid, but-3-yn-2-yl pentyl ester. Glutaric acid, but-3-yn-2-yl isohexyl ester. Glutaric acid, but-3-yn-2-yl propyl ester. Glutaric acid, but-3-yn-2-yl heptyl ester.

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

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