Chemical Properties of «alpha»-Hydroxyarachidic acid, TMSi-Me

InChI

InChI=1S/C24H50O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24(25)26-2)27-28(3,4)5/h23H,6-22H2,1-5H3

InChI Key

AIDIPDFVXORXLT-UHFFFAOYSA-N

Formula

C24H50O3Si

SMILES

CCCCCCCCCCCCCCCCCCC(O[Si](C)(C)C)C(=O)OC

Molecular Weight¹

414.74

Other Names

• Eicosanoic acid, 2-hydroxy, methyl ester, TMS

• 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	1.0524		Relay (1.0) Calculated Property
ΔfG°	-212.97	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-1069.76	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	115.42	kJ/mol	Relay (1.0) Calculated Property
IE	9.93	eV	Relay (1.0) Calculated Property
log10WS	-6.91		Relay (1.0) Calculated Property
logPoct/wat	8.031		Crippen Calculated Property
Pc	269.93	kPa	Relay (1.0-beta) Calculated Property
Inp	[2515.00; 2517.00]
Inp	2517.00		NIST
Inp	2515.00		NIST
Tboil	609.36	K	Relay (1.0) Calculated Property
Tc	787.37	K	Relay (1.0) Calculated Property
Tfus	312.25	K	Relay (1.0) Calculated Property
Vc	1.493	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to «alpha»-Hydroxyarachidic acid, TMSi-Me.

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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