Chemical Properties of Tyrosine, O-trimethylsilyl-, trimethylsilyl ester (CAS 7536-83-6)

InChI

InChI=1S/C15H27NO3Si2/c1-20(2,3)18-13-9-7-12(8-10-13)11-14(16)15(17)19-21(4,5)6/h7-10,14H,11,16H2,1-6H3

InChI Key

VQFWYFBDUJUQRW-UHFFFAOYSA-N

Formula

C15H27NO3Si2

SMILES

C[Si](C)(C)OC(=O)C(N)Cc1ccc(O[Si](C)(C)C)cc1

Molecular Weight¹

325.55

CAS

7536-83-6

Other Names

• Alanine, 3-[p-(trimethylsiloxy)phenyl]-, trimethylsilyl ester
• Tyrosine, diTMS
• Tyrosine, 2tms derivative

• 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	0.7189		Relay (... Calculated Property
ΔfG°	-157.89	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-759.01	kJ/mol	Relay (... Calculated Property
ΔvapH°	82.08	kJ/mol	Relay (... Calculated Property
IE	8.41	eV	Relay (... Calculated Property
log10WS	-2.94		Relay (... Calculated Property
logPoct/wat	3.148		Crippen Calculated Property
Pc	1091.49	kPa	Relay (... Calculated Property ⚠️
Inp	[1901.00; 1901.00]
Inp	1901.00		NIST
Inp	1901.00		NIST
Tboil	594.80	K	Relay (... Calculated Property
Tc	784.64	K	Relay (... Calculated Property
Tfus	358.95	K	Relay (... Calculated Property
Vc	1.020	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to Tyrosine, O-trimethylsilyl-, trimethylsilyl ester.

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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