Chemical Properties of Hydroginkogolinic acid (2TMS)

InChI

InChI=1S/C27H50O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-21-24-22-20-23-25(29-31(2,3)4)26(24)27(28)30-32(5,6)7/h20,22-23H,8-19,21H2,1-7H3

InChI Key

GXOIKIVEMQKZLJ-UHFFFAOYSA-N

Formula

C27H50O3Si2

SMILES

CCCCCCCCCCCCCCc1cccc(O[Si](C)(C)C)c1C(=O)O[Si](C)(C)C

Molecular Weight¹

478.86

• 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	1.1539		Relay (... Calculated Property
ΔfG°	-132.19	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-1029.53	kJ/mol	Relay (... Calculated Property
ΔvapH°	113.40	kJ/mol	Relay (... Calculated Property
IE	9.16	eV	Relay (... Calculated Property
log10WS	-7.89		Relay (... Calculated Property
logPoct/wat	9.136		Crippen Calculated Property
Pc	-61.64	kPa	Relay (... Calculated Property ⚠️
Inp	[2740.80; 2740.80]
Inp	2740.80		NIST
Inp	2740.80		NIST
Tboil	666.74	K	Relay (... Calculated Property
Tc	868.93	K	Relay (... Calculated Property
Tfus	299.50	K	Relay (... Calculated Property
Vc	1.661	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to Hydroginkogolinic acid (2TMS).

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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