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

InChI

InChI=1S/C22H43NO3Si2/c1-6-7-8-9-10-11-12-13-14-15-19-24-27(2,3)26-28(4,5)25-21-22-17-16-18-23-20-22/h16-18,20H,6-15,19,21H2,1-5H3

InChI Key

HRYWAPGKXHZGLP-UHFFFAOYSA-N

Formula

C22H43NO3Si2

SMILES

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

Molecular Weight¹

425.75

Other Names

• 3-(([3-(Dodecyloxy)-1,1,3,3-tetramethyldisiloxanyl]oxy)methyl)pyridine
• 3-({[3-(Dodecyloxy)-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	0.9748		Relay (1.0) Calculated Property
ΔfG°	-16.33	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-867.30	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	101.39	kJ/mol	Relay (1.0) Calculated Property
IE	9.66	eV	Relay (1.0) Calculated Property
log10WS	-5.35		Relay (1.0) Calculated Property
logPoct/wat	6.956		Crippen Calculated Property
Pc	680.90	kPa	Relay (1.0-beta) Calculated Property
Inp	[2444.10; 2444.10]
Inp	2444.10		NIST
Inp	2444.10		NIST
Tboil	638.04	K	Relay (1.0) Calculated Property
Tc	833.87	K	Relay (1.0) Calculated Property
Tfus	252.40	K	Relay (1.0) Calculated Property
Vc	1.452	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 3-(Pyrrol[3-(dodecyloxy)-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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