Chemical Properties of Phenylglycine, tris-TMS

InChI

InChI=1S/C17H33NO2Si3/c1-21(2,3)18(16-13-11-10-12-14-16)15-17(19-22(4,5)6)20-23(7,8)9/h10-15H,1-9H3

InChI Key

FHVNSQVWVRCRNA-UHFFFAOYSA-N

Formula

C17H33NO2Si3

SMILES

C[Si](C)(C)OC(=CN(c1ccccc1)[Si](C)(C)C)O[Si](C)(C)C

Molecular Weight¹

367.71

• 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	0.6485		Relay (1.0) Calculated Property
ΔfG°	103.57	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-660.88	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	77.73	kJ/mol	Relay (1.0) Calculated Property
IE	7.73	eV	Relay (1.0) Calculated Property
log10WS	-4.27		Relay (1.0) Calculated Property
logPoct/wat	5.830		Crippen Calculated Property
Pc	670.67	kPa	Relay (1.0-beta) Calculated Property
Inp	[1940.00; 1940.00]
Inp	1940.00		NIST
Inp	1940.00		NIST
Tboil	576.15	K	Relay (1.0) Calculated Property
Tc	773.89	K	Relay (1.0) Calculated Property
Tfus	321.20	K	Relay (1.0) Calculated Property
Vc	1.206	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Phenylglycine, tris-TMS.

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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