Chemical Properties of 1-phenyl,3,7,10-trimethylsilatrane, e

InChI

InChI=1S/C15H23NO3Si/c1-12-9-16-10-13(2)18-20(17-12,19-14(3)11-16)15-7-5-4-6-8-15/h4-8,12-14H,9-11H2,1-3H3

InChI Key

RJQQQNQWKNMYNG-UHFFFAOYSA-N

Formula

C15H23NO3Si

SMILES

CC1CN2CC(C)O[Si](c3ccccc3)(O1)OC(C)C2

Molecular Weight¹

293.43

• 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	0.4966		Relay (1.0) Calculated Property
ΔfG°	-7.88	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-588.77	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	73.13	kJ/mol	Relay (1.0) Calculated Property
IE	8.44	eV	Relay (1.0) Calculated Property
log10WS	-2.14		Relay (1.0) Calculated Property
logPoct/wat	1.377		Crippen Calculated Property
Pc	1834.56	kPa	Relay (1.0-beta) Calculated Property
Inp	[2022.00; 2022.00]
Inp	2022.00		NIST
Inp	2022.00		NIST
Tboil	566.61	K	Relay (1.0) Calculated Property
Tc	815.95	K	Relay (1.0) Calculated Property
Tfus	438.77	K	Relay (1.0) Calculated Property
Vc	0.856	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 1-phenyl,3,7,10-trimethylsilatrane, e.

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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