Chemical Properties of Cardanol C19:1 (TMS)

InChI

InChI=1S/C28H50OSi/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-27-24-22-25-28(26-27)29-30(2,3)4/h10-11,22,24-26H,5-9,12-21,23H2,1-4H3/b11-10-

InChI Key

NJFQNMYFOHKQGU-KHPPLWFESA-N

Formula

C28H50OSi

SMILES

CCCCCCC=CCCCCCCCCCCCc1cccc(O[Si](C)(C)C)c1

Molecular Weight¹

430.78

• ω : Acentric Factor.
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation 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 Cardanol C19:1 (TMS).

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
• NIST Webbook

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