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

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

InChI
InChI=1S/C13H20O4/c1-5-10(3)9-16-12(14)7-8-13(15)17-11(4)6-2/h2,10-11H,5,7-9H2,1,3-4H3
InChI Key
YZQJYQAKUKHHJL-UHFFFAOYSA-N
Formula
C13H20O4
SMILES
C#CC(C)OC(=O)CCC(=O)OCC(C)CC
Molecular Weight1
240.30
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 34.09 kJ/mol Joback Calculated Property
ΔvapH° 74.04 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 1.921 Crippen Calculated Property
McVol 200.310 ml/mol McGowan Calculated Property
Pc 1903.58 kPa Joback Calculated Property
Inp [1539.00; 1539.00]   Show Hide
Inp 1539.00 NIST
Inp 1539.00 NIST
Tboil 525.63 K Relay (1.0) Calculated Property
Tc 703.60 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Volume, Enthalpy of formation 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 [513.30; 592.49] J/mol×K [602.72; 789.43] Show Hide
Cp,gas 513.30 J/mol×K 602.72 Joback Calculated Property
Cp,gas 528.44 J/mol×K 633.84 Joback Calculated Property
Cp,gas 542.80 J/mol×K 664.96 Joback Calculated Property
Cp,gas 556.37 J/mol×K 696.07 Joback Calculated Property
Cp,gas 569.18 J/mol×K 727.19 Joback Calculated Property
Cp,gas 581.21 J/mol×K 758.31 Joback Calculated Property
Cp,gas 592.49 J/mol×K 789.43 Joback Calculated Property

Similar Compounds

Succinic acid, but-3-yn-2-yl 2-ethylbutyl ester. Glutaric acid, but-3-yn-2-yl 2-methylbutyl ester. Succinic acid, but-3-yn-2-yl 2-methylpentyl ester. Glutaric acid, but-3-yn-2-yl 2-ethylbutyl ester. Glutaric acid, but-3-yn-2-yl 2-methylpentyl ester. Succinic acid, 3-methylbut-2-yl 2-methylbutyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 2-methylbutyl ester. Butanedioic acid, ethyl-(2-methyl-1-butyl) ester. Glutaric acid, 2-ethylhexyl but-3-yn-2-yl ester. Glutaric acid, but-3-yn-2-yl 2,4,4-trimethylpentyl ester. Glutaric acid, cyclohexylmethyl but-3-yn-2-yl ester. Succinic acid, di(2-methylbutyl) ester. Succinic acid, 3-methylbut-2-yl 2-ethylbutyl ester. Succinic acid, but-3-yn-2-yl 3-methylpentyl ester. Glutaric acid, but-3-yn-2-yl isobutyl ester.

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

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.