Chemical Properties of Succinic acid, but-3-yn-2-yl 3-methylpentyl ester

Succinic acid, but-3-yn-2-yl 3-methylpentyl ester

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

Property Value Unit Source
ΔfusH° 36.68 kJ/mol Joback Calculated Property
logPoct/wat 2.311 Crippen Calculated Property
McVol 214.400 ml/mol McGowan Calculated Property
Inp [1641.00; 1641.00]   Show Hide
Inp 1641.00 NIST
Inp 1641.00 NIST
Tboil 537.84 K Relay (1.0) Calculated Property
Tc 718.74 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [564.66; 646.40] J/mol×K [625.60; 810.51] Show Hide
Cp,gas 564.66 J/mol×K 625.60 Joback Calculated Property
Cp,gas 580.31 J/mol×K 656.42 Joback Calculated Property
Cp,gas 595.14 J/mol×K 687.24 Joback Calculated Property
Cp,gas 609.16 J/mol×K 718.05 Joback Calculated Property
Cp,gas 622.37 J/mol×K 748.87 Joback Calculated Property
Cp,gas 634.78 J/mol×K 779.69 Joback Calculated Property
Cp,gas 646.40 J/mol×K 810.51 Joback Calculated Property

Similar Compounds

Glutaric acid, but-3-yn-2-yl 3-methyl-5-methoxypentyl ester. Glutaric acid, but-3-yn-2-yl 3,7-dimethyloctyl ester. Glutaric acid, 2-(cyclohexyl)ethyl but-3-yn-2-yl ester. Glutaric acid, but-3-yn-2-yl isohexyl ester. Succinic acid, but-3-yn-2-yl 2-methylpentyl ester. Glutaric acid, but-3-yl-2-yn 3-methylbutyl ester. Sebacic acid, but-3-yn-2-yl isohexyl ester. Succinic acid, but-3-yn-2-yl 2-ethylbutyl ester. Succinic acid, ethyl 3-methylpentyl ester. Succinic acid, di(3-methylpentyl) ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 3-methylpentyl ester. Succinic acid, butyl 3-methylpentyl ester. Succinic acid, 3-methylpentyl pentyl ester. Succinic acid, 3-methylpentyl propyl ester. Succinic acid, but-3-yn-2-yl 4-methylpent-2-yl ester.

Find more compounds similar to Succinic acid, but-3-yn-2-yl 3-methylpentyl ester.

Sources

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