Chemical Properties of Glutaric acid, 3-methylbut-2-en-1-yl hex-4-yn-3-yl ester

Glutaric acid, 3-methylbut-2-en-1-yl hex-4-yn-3-yl ester

InChI
InChI=1S/C16H24O4/c1-5-8-14(6-2)20-16(18)10-7-9-15(17)19-12-11-13(3)4/h11,14H,6-7,9-10,12H2,1-4H3
InChI Key
JCFQXMXZIZYBOK-UHFFFAOYSA-N
Formula
C16H24O4
SMILES
CC#CC(CC)OC(=O)CCCC(=O)OCC=C(C)C
Molecular Weight1
280.36
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 41.26 kJ/mol Joback Calculated Property
logPoct/wat 3.011 Crippen Calculated Property
McVol 238.280 ml/mol McGowan Calculated Property
Inp [1898.00; 1898.00]   Show Hide
Inp 1898.00 NIST
Inp 1898.00 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 [664.55; 746.68] J/mol×K [730.66; 930.21] Show Hide
Cp,gas 664.55 J/mol×K 730.66 Joback Calculated Property
Cp,gas 680.41 J/mol×K 763.92 Joback Calculated Property
Cp,gas 695.38 J/mol×K 797.18 Joback Calculated Property
Cp,gas 709.47 J/mol×K 830.44 Joback Calculated Property
Cp,gas 722.71 J/mol×K 863.69 Joback Calculated Property
Cp,gas 735.11 J/mol×K 896.95 Joback Calculated Property
Cp,gas 746.68 J/mol×K 930.21 Joback Calculated Property

Similar Compounds

Glutaric acid, 3-methylbut-2-en-1-yl non-5-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl but-3-en-1-yl ester. Glutaric acid, hex-4-yn-3-yl propyl ester. Glutaric acid, ethyl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl 2-fluoroethyl ester. Glutaric acid, hex-4-yn-3-yl cis-hex-3-enyl ester. Glutaric acid, butyl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl isobutyl ester. Glutaric acid, but-3-en-2-yl hex-4-yn-3-yl ester. Glutaric acid, 3-methylbut-2-en-1-yl but-3-yn-2-yl ester. Glutaric acid, di(hex-4-yn-3-yl) ester. Glutaric acid, but-3-yn-2-yl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl isopropyl ester. Glutaric acid, hex-4-yn-3-yl pentyl ester. Succinic acid, hex-4-yn-3-yl 3-methylbut-3-en-1-yl ester.

Find more compounds similar to Glutaric acid, 3-methylbut-2-en-1-yl hex-4-yn-3-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.