Chemical Properties of Glutaric acid, 2,2,2-triluoroethyl 2-methylhex-3-yl ester

Glutaric acid, 2,2,2-triluoroethyl 2-methylhex-3-yl ester

InChI
InChI=1S/C14H23F3O4/c1-4-6-11(10(2)3)21-13(19)8-5-7-12(18)20-9-14(15,16)17/h10-11H,4-9H2,1-3H3
InChI Key
JQWJYMWLZXJVSB-UHFFFAOYSA-N
Formula
C14H23F3O4
SMILES
CCCC(OC(=O)CCCC(=O)OCC(F)(F)F)C(C)C
Molecular Weight1
312.33
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 -1605.89 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 35.53 kJ/mol Joback Calculated Property
ΔvapH° 73.35 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.630 Crippen Calculated Property
McVol 228.310 ml/mol McGowan Calculated Property
Inp [1481.00; 1481.00]   Show Hide
Inp 1481.00 NIST
Inp 1481.00 NIST
Tboil 530.52 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, 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 [635.96; 716.81] J/mol×K [630.06; 795.63] Show Hide
Cp,gas 635.96 J/mol×K 630.06 Joback Calculated Property
Cp,gas 651.37 J/mol×K 657.65 Joback Calculated Property
Cp,gas 665.98 J/mol×K 685.25 Joback Calculated Property
Cp,gas 679.81 J/mol×K 712.84 Joback Calculated Property
Cp,gas 692.89 J/mol×K 740.44 Joback Calculated Property
Cp,gas 705.21 J/mol×K 768.03 Joback Calculated Property
Cp,gas 716.81 J/mol×K 795.63 Joback Calculated Property

Similar Compounds

Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-methylhex-3-yl ester. Succinic acid, 2-methylhex-3-yl 2,2,2-trifluoroethyl ester. Glutaric acid, di(2-methylhex-3-yl) ester. Glutaric acid, 2-methylpent-3-yl 2-methylhex-3-yl ester. Glutaric acid, 3-methylbut-2-yl 2-methylhex-3-yl ester. Glutaric acid, 2-methylpent-3-yl 3-hexyl ester. Glutaric acid, 2-methylpent-3-yl hept-4-yl ester. Glutaric acid, 2,2,3,3-tetrafluoropropyl 2-methylhex-3-yl ester. Glutaric acid, 2,2-dimethylpent-3-yl 2-methylhex-3-yl ester. Glutaric acid, 2-methylhex-3-yl 3-octyl ester. Glutaric acid, hept-2-yl 2-methylhex-3-yl ester. Glutaric acid, dec-2-yl 2-methylhex-3-yl ester. Glutaric acid, 2-methylhex-3-yl 5-methylhex-2-yl ester. Glutaric acid, 4,4-dimethylpent-2-yl 2-methylhex-3-yl ester. Glutaric acid, 2-methylpent-3-yl 3-octyl ester.

Find more compounds similar to Glutaric acid, 2,2,2-triluoroethyl 2-methylhex-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.