Chemical Properties of 3-(Pyrrol[3-(hexyloxy)-1,1,3,3-tetramethyldisiloxanyl]oxymorphomethyl)pyridine

InChI

InChI=1S/C16H31NO3Si2/c1-6-7-8-9-13-18-21(2,3)20-22(4,5)19-15-16-11-10-12-17-14-16/h10-12,14H,6-9,13,15H2,1-5H3

InChI Key

KGMFAUMHLVYXNM-UHFFFAOYSA-N

Formula

C16H31NO3Si2

SMILES

CCCCCCO[Si](C)(C)O[Si](C)(C)OCc1cccnc1

Molecular Weight¹

341.59

Other Names

• 3-(([3-(Hexyloxy)-1,1,3,3-tetramethyldisiloxanyl]oxy)methyl)pyridine
• 3-({[3-(Hexyloxy)-1,1,3,3-tetramethyldisiloxanyl]oxy}methyl)pyridine

• 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	0.7389		Relay (... Calculated Property
ΔfG°	-61.62	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-745.34	kJ/mol	Relay (... Calculated Property
ΔvapH°	78.52	kJ/mol	Relay (... Calculated Property
IE	9.55	eV	Relay (... Calculated Property
log10WS	-2.69		Relay (... Calculated Property
logPoct/wat	4.615		Crippen Calculated Property
Pc	1191.43	kPa	Relay (... Calculated Property ⚠️
Inp	[1864.10; 1864.10]
Inp	1864.10		NIST
Inp	1864.10		NIST
Tboil	586.47	K	Relay (... Calculated Property
Tc	775.52	K	Relay (... Calculated Property
Tfus	235.79	K	Relay (... Calculated Property
Vc	1.119	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to 3-(Pyrrol[3-(hexyloxy)-1,1,3,3-tetramethyldisiloxanyl]oxymorphomethyl)pyridine.

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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