Chemical Properties of Succinic acid, 3-methylbut-2-yl 2-methyloct-5-yn-4-yl ester

Succinic acid, 3-methylbut-2-yl 2-methyloct-5-yn-4-yl ester

InChI
InChI=1S/C18H30O4/c1-7-8-9-16(12-13(2)3)22-18(20)11-10-17(19)21-15(6)14(4)5/h13-16H,7,10-12H2,1-6H3
InChI Key
KNJFKNGTZNPPSJ-UHFFFAOYSA-N
Formula
C18H30O4
SMILES
CCC#CC(CC(C)C)OC(=O)CCC(=O)OC(C)C(C)C
Molecular Weight1
310.43
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
Δfus 40.14 kJ/mol Joback Calculated Property
logPoct/wat 3.726 Crippen Calculated Property
McVol 270.760 ml/mol McGowan Calculated Property
Inp [1904.00; 1904.00]   Show Hide
Inp 1904.00 NIST
Inp 1904.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, 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 [789.72; 880.86] J/mol×K [735.12; 927.81] Show Hide
Cp,gas 789.72 J/mol×K 735.12 Joback Calculated Property
Cp,gas 807.63 J/mol×K 767.24 Joback Calculated Property
Cp,gas 824.43 J/mol×K 799.35 Joback Calculated Property
Cp,gas 840.14 J/mol×K 831.47 Joback Calculated Property
Cp,gas 854.77 J/mol×K 863.58 Joback Calculated Property
Cp,gas 868.34 J/mol×K 895.70 Joback Calculated Property
Cp,gas 880.86 J/mol×K 927.81 Joback Calculated Property

Similar Compounds

Succinic acid, 2-methylpent-3-yl 2-methyloct-5-yn-4-yl ester. Glutaric acid, 3-methylbut-2-yl 2-methyloct-5-yn-4-yl ester. Succinic acid, di(2-methyloct-5-yn-4-yl) ester. Succinic acid, hex-4-yn-3-yl 2-methyloct-5-yn-4-yl ester. Succinic acid, hept-2-yl 2-methyloct-5-yn-4-yl ester. Glutaric acid, 2-methylpent-3-yl 2-methyloct-5-yn-4-yl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 2-methyloct-5-yn-4-yl ester. Butanoic acid, 2-methyloct-5-yn-4-yl ester. Glutaric acid, isobutyl 2-methyloct-5-yn-4-yl ester. Succinic acid, 2,2-dichloroethyl 2-methyloct-5-yn-4-yl ester. Sebacic acid, isobutyl 2-methyloct-5-yn-4-yl ester. valeric acid, 2-methyloct-5-yn-4-yl ester. Glutaric acid, di(2-methyloct-5-yn-4-yl) ester. Octanoic acid, 2-methyloct-5-yn-4-yl ester. Hexanoic acid, 2-methyloct-5-yn-4-yl ester.

Find more compounds similar to Succinic acid, 3-methylbut-2-yl 2-methyloct-5-yn-4-yl 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.