Chemical Properties of Erucic acid, benzyldimethylsilyl ester

InChI

InChI=1S/C31H54O2Si/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-28-31(32)33-34(2,3)29-30-26-23-22-24-27-30/h11-12,22-24,26-27H,4-10,13-21,25,28-29H2,1-3H3/b12-11+

InChI Key

FRPCXQDGZFJAOQ-VAWYXSNFSA-N

Formula

C31H54O2Si

SMILES

CCCCCCCC/C=C/CCCCCCCCCCCC(=O)O[Si](C)(C)Cc1ccccc1

Molecular Weight¹

486.86

• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical 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 Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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.

Similar Compounds

Find more compounds similar to Erucic acid, benzyldimethylsilyl 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
• NIST Webbook

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