Chemical Properties of Glutaric acid, hex-4-yn-3-yl nonyl ester

Glutaric acid, hex-4-yn-3-yl nonyl ester

InChI
InChI=1S/C20H34O4/c1-4-7-8-9-10-11-12-17-23-19(21)15-13-16-20(22)24-18(6-3)14-5-2/h18H,4,6-13,15-17H2,1-3H3
InChI Key
WGKOFRXLQDZCRV-UHFFFAOYSA-N
Formula
C20H34O4
SMILES
CC#CC(CC)OC(=O)CCCC(=O)OCCCCCCCCC
Molecular Weight1
338.48
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
ΔfH°gas -799.57 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 55.89 kJ/mol Joback Calculated Property
ΔvapH° 96.29 kJ/mol Relay (1.0) Calculated Property
log10WS -4.98 Relay (1.0) Calculated Property
logPoct/wat 4.796 Crippen Calculated Property
McVol 298.940 ml/mol McGowan Calculated Property
Pc 1141.34 kPa Joback Calculated Property
Inp 2356.00 NIST
Tboil 603.73 K Relay (1.0) Calculated Property
Tc 794.40 K Relay (1.0) Calculated Property
Tfus 290.84 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [904.96; 995.29] J/mol×K [782.20; 968.75] Show Hide
Cp,gas 904.96 J/mol×K 782.20 Joback Calculated Property
Cp,gas 922.69 J/mol×K 813.29 Joback Calculated Property
Cp,gas 939.32 J/mol×K 844.38 Joback Calculated Property
Cp,gas 954.88 J/mol×K 875.47 Joback Calculated Property
Cp,gas 969.39 J/mol×K 906.56 Joback Calculated Property
Cp,gas 982.85 J/mol×K 937.65 Joback Calculated Property
Cp,gas 995.29 J/mol×K 968.75 Joback Calculated Property

Similar Compounds

Glutaric acid, heptadecyl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl octyl ester. Glutaric acid, hex-4-yn-3-yl octadecyl ester. Glutaric acid, hex-4-yn-3-yl hexadecyl ester. Glutaric acid, hex-4-yn-3-yl undecyl ester. Glutaric acid, decyl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl tridecyl ester. Glutaric acid, hex-4-yn-3-yl tetradecyl ester. Glutaric acid, hex-4-yn-3-yl pentadecyl ester. Glutaric acid, dodecyl hex-4-yn-3-yl ester. Glutaric acid, heptyl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl hexyl ester. Sebacic acid, hexyl hex-4-yn-3-yl ester. Sebacic acid, hex-4-yn-3-yl tetradecyl ester. Sebacic acid, hex-4-yn-3-yl pentadecyl ester.

Find more compounds similar to Glutaric acid, hex-4-yn-3-yl nonyl 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.