Chemical Properties of Hexadecanoic acid, 6-methyl-2-trimethylsilyloxy, methyl ester

InChI

InChI=1S/C21H44O3Si/c1-7-8-9-10-11-12-13-14-16-19(2)17-15-18-20(21(22)23-3)24-25(4,5)6/h19-20H,7-18H2,1-6H3

InChI Key

HGYYJIIFBGDABE-UHFFFAOYSA-N

Formula

C21H44O3Si

SMILES

CCCCCCCCCCC(C)CCCC(O[Si](C)(C)C)C(=O)OC

Molecular Weight¹

372.67

• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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

Property	Value	Unit	Source
ΔvapH°	100.58	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	6.717		Crippen Calculated Property
Inp	[2154.00; 2154.00]
Inp	2154.00		NIST
Inp	2154.00		NIST
Tboil	587.08	K	Relay (1.0) Calculated Property
Tc	757.17	K	Relay (1.0) Calculated Property
Tfus	267.66	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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 Hexadecanoic acid, 6-methyl-2-trimethylsilyloxy, methyl 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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