Chemical Properties of «gamma»-Aminobutyric acid, mono-ethoxycarbonylated, bis-TBDMS

InChI

InChI=1S/C19H41NO4Si2/c1-12-23-17(22)20(25(8,9)18(2,3)4)15-13-14-16(21)24-26(10,11)19(5,6)7/h12-15H2,1-11H3

InChI Key

MSSYLKVCRUQWOV-UHFFFAOYSA-N

Formula

C19H41NO4Si2

SMILES

CCOC(=O)N(CCCC(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C

Molecular Weight¹

403.70

• 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	0.8006		Relay (... Calculated Property
ΔfG°	-217.83	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-1183.23	kJ/mol	Relay (... Calculated Property
ΔvapH°	79.61	kJ/mol	Relay (... Calculated Property
IE	8.08	eV	Relay (... Calculated Property
log10WS	-3.55		Relay (... Calculated Property
logPoct/wat	5.779		Crippen Calculated Property
Pc	1099.84	kPa	Relay (... Calculated Property ⚠️
Inp	[2110.00; 2110.00]
Inp	2110.00		NIST
Inp	2110.00		NIST
Tboil	590.94	K	Relay (... Calculated Property
Tc	796.38	K	Relay (... Calculated Property
Tfus	335.34	K	Relay (... Calculated Property
Vc	1.329	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to «gamma»-Aminobutyric acid, mono-ethoxycarbonylated, bis-TBDMS.

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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