Chemical Properties of Glycine, N-(2-methyl-1-oxo-2-butenyl)-N-(trimethylsilyl)-, trimethylsilyl ester, (E)- (CAS 55517-45-8)

InChI

InChI=1S/C13H27NO3Si2/c1-9-11(2)13(16)14(18(3,4)5)10-12(15)17-19(6,7)8/h9H,10H2,1-8H3/b11-9+

InChI Key

VUISAWSCGJCPQU-PKNBQFBNSA-N

Formula

C13H27NO3Si2

SMILES

CC=C(C)C(=O)N(CC(=O)O[Si](C)(C)C)[Si](C)(C)C

Molecular Weight¹

301.53

CAS

55517-45-8

Other Names

• Tiglyl glycine, bis(trimethylsilyl)-
• Tiglyl glycine, 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	0.6048		Relay (1.0) Calculated Property
ΔfG°	-157.77	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-789.58	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	69.28	kJ/mol	Relay (1.0) Calculated Property
IE	8.46	eV	Relay (1.0) Calculated Property
log10WS	-2.10		Relay (1.0) Calculated Property
logPoct/wat	2.994		Crippen Calculated Property
Pc	1113.94	kPa	Relay (1.0-beta) Calculated Property
Inp	[1549.00; 1579.00]
Inp	1579.00		NIST
Inp	1549.00		NIST
Inp	1549.00		NIST
Inp	1549.00		NIST
Inp	1549.00		NIST
Inp	1579.00		NIST
Tboil	534.71	K	Relay (1.0) Calculated Property
Tc	720.94	K	Relay (1.0) Calculated Property
Tfus	300.45	K	Relay (1.0) Calculated Property
Vc	0.966	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Glycine, N-(2-methyl-1-oxo-2-butenyl)-N-(trimethylsilyl)-, trimethylsilyl ester, (E)-.

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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