Chemical Properties of Trimethylsilyl 2-amino-3-(3-chloro-4-[(trimethylsilyl)oxy]phenyl)propanoate

InChI

InChI=1S/C15H26ClNO3Si2/c1-21(2,3)19-14-8-7-11(9-12(14)16)10-13(17)15(18)20-22(4,5)6/h7-9,13H,10,17H2,1-6H3

InChI Key

HOUWOLDVTDFTBV-UHFFFAOYSA-N

Formula

C15H26ClNO3Si2

SMILES

C[Si](C)(C)OC(=O)C(N)Cc1ccc(O[Si](C)(C)C)c(Cl)c1

Molecular Weight¹

360.00

Other Names

• 2-Amino-3-(3-chloro-4-hydroxy-phenyl)propanoic acid, O, O'-bis(trimethylsilyl)-
• Trimethylsilyl 2-amino-3-{3-chloro-4-[(trimethylsilyl)oxy]phenyl}propanoate

• 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	0.7320		Relay (1.0) Calculated Property
ΔfG°	-188.57	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-793.17	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	85.78	kJ/mol	Relay (1.0) Calculated Property
IE	8.53	eV	Relay (1.0) Calculated Property
log10WS	-3.73		Relay (1.0) Calculated Property
logPoct/wat	3.802		Crippen Calculated Property
Pc	1091.90	kPa	Relay (1.0-beta) Calculated Property
Inp	[2062.00; 2062.00]
Inp	2062.00		NIST
Inp	2062.00		NIST
Tboil	590.45	K	Relay (1.0) Calculated Property
Tc	810.78	K	Relay (1.0) Calculated Property
Tfus	365.67	K	Relay (1.0) Calculated Property
Vc	1.058	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Trimethylsilyl 2-amino-3-(3-chloro-4-[(trimethylsilyl)oxy]phenyl)propanoate.

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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