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

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

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InChI
InChI=1S/C12H18O4/c1-5-10(4)16-12(14)8-6-7-11(13)15-9(2)3/h1,9-10H,6-8H2,2-4H3
InChI Key
GIMMHMKISOBPSW-UHFFFAOYSA-N
Formula
C12H18O4
SMILES
C#CC(C)OC(=O)CCCC(=O)OC(C)C
Molecular Weight1
226.27
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Physical Properties

Property Value Unit Source
Δf -199.49 kJ/mol Joback Calculated Property
Δfgas -499.27 kJ/mol Joback Calculated Property
Δfus 28.34 kJ/mol Joback Calculated Property
Δvap 59.70 kJ/mol Joback Calculated Property
log10WS -2.59 Crippen Calculated Property
logPoct/wat 1.673 Crippen Calculated Property
McVol 186.220 ml/mol McGowan Calculated Property
Pc 2237.64 kPa Joback Calculated Property
Inp 1410.00 NIST
Tboil 615.78 K Joback Calculated Property
Tc 809.26 K Joback Calculated Property
Tfus 386.29 K Joback Calculated Property
Vc 0.706 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [473.55; 547.46] J/mol×K [615.78; 809.26] Show Hide
Cp,gas 473.55 J/mol×K 615.78 Joback Calculated Property
Cp,gas 487.57 J/mol×K 648.03 Joback Calculated Property
Cp,gas 500.91 J/mol×K 680.27 Joback Calculated Property
Cp,gas 513.56 J/mol×K 712.52 Joback Calculated Property
Cp,gas 525.53 J/mol×K 744.76 Joback Calculated Property
Cp,gas 536.83 J/mol×K 777.01 Joback Calculated Property
Cp,gas 547.46 J/mol×K 809.26 Joback Calculated Property

Similar Compounds

Glutaric acid, di(but-3-yn-2-yl) ester. Glutaric acid, but-3-yn-2-yl ethyl ester. Valeric acid, but-3-yn-2-yl ester. Glutaric acid, but-3-yn-2-yl propyl ester. Hexanoic acid, but-3-yn-2-yl ester. Glutaric acid, monochloride, but-3-yn-2-yl ester. Sebacic acid, di(but-3-yn-2-yl) ester. Octanoic acid, but-3-yn-2-yl ester. Diisopropyl glutarate. Glutaric acid, but-3-yn-2-yl butyl ester. Glutaric acid, 2,2-dichloroethyl but-3-yn-2-yl ester. Glutaric acid, but-3-yn-2-yl neopentyl ester. 4-Bromobutanoic acid, but-3-yn-2-yl ester. Glutaric acid, but-3-yn-2-yl isobutyl ester. 5-Bromovaleric acid, but-3-yn-2-yl ester.

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

Sources

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