Chemical Properties of Glutaric acid, tridec-2-yn-1-yl cis-4-tert-butylcyclohexyl ester

Glutaric acid, tridec-2-yn-1-yl cis-4-tert-butylcyclohexyl ester

InChI
InChI=1S/C28H48O4/c1-5-6-7-8-9-10-11-12-13-14-15-23-31-26(29)17-16-18-27(30)32-25-21-19-24(20-22-25)28(2,3)4/h24-25H,5-13,16-23H2,1-4H3
InChI Key
PZUGPHAXGQXGAD-UHFFFAOYSA-N
Formula
C28H48O4
SMILES
CCCCCCCCCCC#CCOC(=O)CCCC(=O)OC1CCC(C(C)(C)C)CC1
Molecular Weight1
448.69
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° 65.63 kJ/mol Joback Calculated Property
ΔvapH° 124.58 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 7.382 Crippen Calculated Property
McVol 400.800 ml/mol McGowan Calculated Property
Inp [3140.00; 3140.00]   Show Hide
Inp 3140.00 NIST
Inp 3140.00 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, 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 [1400.13; 1488.43] J/mol×K [977.33; 1196.65] Show Hide
Cp,gas 1400.13 J/mol×K 977.33 Joback Calculated Property
Cp,gas 1419.19 J/mol×K 1013.88 Joback Calculated Property
Cp,gas 1436.42 J/mol×K 1050.44 Joback Calculated Property
Cp,gas 1451.89 J/mol×K 1086.99 Joback Calculated Property
Cp,gas 1465.66 J/mol×K 1123.54 Joback Calculated Property
Cp,gas 1477.82 J/mol×K 1160.09 Joback Calculated Property
Cp,gas 1488.43 J/mol×K 1196.65 Joback Calculated Property

Similar Compounds

Glutaric acid, tridec-2-yn-1-yl trans-4-tert-butylcyclohexyl ester. Glutaric acid, 3,4-dimethylcyclohexyl tridec-2-yn-1-yl ester. Succinic acid, tridec-2-yn-1-yl trans-4-methylcyclohexyl ester. Succinic acid, tridec-2-yn-1-yl cis-4-methylcyclohexyl ester. Glutaric acid, tridec-2-yn-1-yl 2-methylhex-3-yl ester. Glutaric acid, 1-cyclopentylethyl tridec-2-yn-1-yl ester. Glutaric acid, tridec-2-yn-1-yl 3-octyl ester. Glutaric acid, tridec-2-yn-1-yl 4-methylpent-2-yl ester. Glutaric acid, tridec-2-yn-1-yl 2-methylpent-3-yl ester. Glutaric acid, 2-ethylhexyl cis-4-tert-butylcyclohexyl ester. Glutaric acid, tridec-2-yn-1-yl hept-4-yl ester. Glutaric acid, cyclopentyl tridec-2-yn-1-yl ester. Glutaric acid, hept-2-yl trans-4-tert-butylcyclohexyl ester. Glutaric acid, di(cis-4-tert-butylcyclohexyl) ester. Glutaric acid, di(trans-4-tert-butylcyclohexyl) ester.

Find more compounds similar to Glutaric acid, tridec-2-yn-1-yl cis-4-tert-butylcyclohexyl 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.