Chemical Properties of 2,6-Pyridinedicarboxylic acid, 2-ethylhexyl tridecyl ester

InChI

InChI=1S/C28H47NO4/c1-4-7-9-10-11-12-13-14-15-16-17-22-32-27(30)25-20-18-21-26(29-25)28(31)33-23-24(6-3)19-8-5-2/h18,20-21,24H,4-17,19,22-23H2,1-3H3

InChI Key

VCZRNOWKUIASKS-UHFFFAOYSA-N

Formula

C28H47NO4

SMILES

CCCCCCCCCCCCCOC(=O)c1cccc(C(=O)OCC(CC)CCCC)n1

Molecular Weight¹

461.69

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, 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.

Similar Compounds

Find more compounds similar to 2,6-Pyridinedicarboxylic acid, 2-ethylhexyl tridecyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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