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

372.66

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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

Property	Value	Unit	Source
ω	0.8998		Relay (... Calculated Property
ΔfG°	-241.83	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-1031.72	kJ/mol	Relay (... Calculated Property
ΔvapH°	98.78	kJ/mol	Relay (... Calculated Property
IE	9.75	eV	Relay (... Calculated Property
log10WS	-5.70		Relay (... Calculated Property
logPoct/wat	6.717		Crippen Calculated Property
Pc	561.02	kPa	Relay (... Calculated Property ⚠️
Inp	[2154.00; 2154.00]
Inp	2154.00		NIST
Inp	2154.00		NIST
Tboil	587.08	K	Relay (... Calculated Property
Tc	752.35	K	Relay (... Calculated Property
Tfus	270.23	K	Relay (... Calculated Property
Vc	1.306	m3/kmol	Relay (... Calculated Property

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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