Chemical Properties of Benzoic acid, 3-hydroxy-, tert.-butyldimethylsilyl ester

InChI

InChI=1S/C13H20O3Si/c1-13(2,3)17(4,5)16-12(15)10-7-6-8-11(14)9-10/h6-9,14H,1-5H3

InChI Key

ZNWANTDZMJTLBH-UHFFFAOYSA-N

Formula

C13H20O3Si

SMILES

CC(C)(C)[Si](C)(C)OC(=O)c1cccc(O)c1

Molecular Weight¹

252.38

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• P_c : Critical Pressure (kPa).
• 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 Volume, 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 Benzoic acid, 3-hydroxy-, tert.-butyldimethylsilyl 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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