Chemical Properties of Glutaric acid, (2-chlorocyclohexyl)methyl but-3-yn-2-yl ester

Glutaric acid, (2-chlorocyclohexyl)methyl but-3-yn-2-yl ester

InChI
InChI=1S/C16H23ClO4/c1-3-12(2)21-16(19)10-6-9-15(18)20-11-13-7-4-5-8-14(13)17/h1,12-14H,4-11H2,2H3
InChI Key
GSHXLKDRXZKNSM-UHFFFAOYSA-N
Formula
C16H23ClO4
SMILES
C#CC(C)OC(=O)CCCC(=O)OCC1CCCCC1Cl
Molecular Weight1
314.80
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 42.49 kJ/mol Joback Calculated Property
logPoct/wat 3.062 Crippen Calculated Property
McVol 243.960 ml/mol McGowan Calculated Property
Inp [2166.00; 2166.00]   Show Hide
Inp 2166.00 NIST
Inp 2166.00 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 [698.43; 785.20] J/mol×K [724.11; 932.45] Show Hide
Cp,gas 698.43 J/mol×K 724.11 Joback Calculated Property
Cp,gas 716.06 J/mol×K 758.83 Joback Calculated Property
Cp,gas 732.39 J/mol×K 793.56 Joback Calculated Property
Cp,gas 747.46 J/mol×K 828.28 Joback Calculated Property
Cp,gas 761.27 J/mol×K 863.00 Joback Calculated Property
Cp,gas 773.84 J/mol×K 897.73 Joback Calculated Property
Cp,gas 785.20 J/mol×K 932.45 Joback Calculated Property

Similar Compounds

Glutaric acid, (2-chlorocyclohexyl)methyl hept-2-yl ester. Glutaric acid, (2-chlorocyclohexyl)methyl dec-2-yl ester. Glutaric acid, (2-chlorocyclohexyl)methyl cyclohexylmethyl ester. Glutaric acid, di((2-chlorocyclohexyl)methyl) ester. Glutaric acid, (2-chlorocyclohexyl)methyl 1,1,1-trifluoroprop-2-yl ester. Glutaric acid, (2-chlorocyclohexyl)methyl 2-methylpent-3-yl ester. Glutaric acid, (2-chlorocyclohexyl)methyl 2-ethylhexyl ester. Glutaric acid, (2-chlorocyclohexyl)methyl 8-chlorooctyl ester. Succinic acid, 3-methylbut-2-yl (2-chlorocyclohexyl)methyl ester. Succinic acid, dec-2-yl (2-chlorocyclohexyl)methyl ester. Succinic acid, hept-2-yl (2-chlorocyclohexyl)methyl ester. Glutaric acid, (2-chlorocyclohexyl)methyl 2,2-dichloroethyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl (2-chlorocyclohexyl)methyl ester. Glutaric acid, (2-chlorocyclohexyl)methyl 2,2,3,3-tetrafluoropropyl ester. Succinic acid, di((2-chlorocyclohexyl)methyl) ester.

Find more compounds similar to Glutaric acid, (2-chlorocyclohexyl)methyl but-3-yn-2-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.