Chemical Properties of 2-Isopropylbenzenethiol, S-trimethylsilyl-

InChI

InChI=1S/C12H20SSi/c1-10(2)11-8-6-7-9-12(11)13-14(3,4)5/h6-10H,1-5H3

InChI Key

VMRPHIVWFJYIAT-UHFFFAOYSA-N

Formula

C12H20SSi

SMILES

CC(C)c1ccccc1S[Si](C)(C)C

Molecular Weight¹

224.44

Other Names

• 2-Isopropylbenzenethiol, tms derivative

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Standard Gibbs free energy of formation, Acentric Factor 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-Isopropylbenzenethiol, S-trimethylsilyl-.

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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