Chemical Properties of Leu-Trp, N-trimethylsilyl-, trimethylsilyl ester

InChI

InChI=1S/C23H39N3O3Si2/c1-16(2)13-20(26-30(3,4)5)22(27)25-21(23(28)29-31(6,7)8)14-17-15-24-19-12-10-9-11-18(17)19/h9-12,15-16,20-21,24,26H,13-14H2,1-8H3,(H,25,27)

InChI Key

HMLCTIBFSHLOBM-UHFFFAOYSA-N

Formula

C23H39N3O3Si2

SMILES

CC(C)CC(N[Si](C)(C)C)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O[Si](C)(C)C

Molecular Weight¹

461.75

Other Names

• Trimethylsilyl N-(trimethylsilyl)-l-leucyl-l-tryptophanate

• 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	0.9087		Relay (... Calculated Property
ΔfG°	42.66	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-789.83	kJ/mol	Relay (... Calculated Property
ΔvapH°	122.34	kJ/mol	Relay (... Calculated Property
IE	7.79	eV	Relay (... Calculated Property
log10WS	-4.11		Relay (... Calculated Property
logPoct/wat	3.931		Crippen Calculated Property
Pc	503.56	kPa	Relay (... Calculated Property ⚠️
Inp	[2840.80; 2840.80]
Inp	2840.80		NIST
Inp	2840.80		NIST
Tboil	681.20	K	Relay (... Calculated Property
Tc	979.62	K	Relay (... Calculated Property
Tfus	393.78	K	Relay (... Calculated Property
Vc	1.392	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to Leu-Trp, N-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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