Chemical Properties of N-Acetyl-L-aspartic acid, N-(tert-butyldimethylsilyl)-, bis(tert-butyldimethylsilyl) ester

InChI

InChI=1S/C24H51NO5Si3/c1-18(26)25(31(11,12)22(2,3)4)19(21(28)30-33(15,16)24(8,9)10)17-20(27)29-32(13,14)23(5,6)7/h19H,17H2,1-16H3

InChI Key

CWTLUKMQFOTZND-UHFFFAOYSA-N

Formula

C24H51NO5Si3

SMILES

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

Molecular Weight¹

517.92

Other Names

• N-Acetylaspartic acid, diTBDMS

• 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	0.8354		Relay (1.0) Calculated Property
ΔfG°	-302.65	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-1471.23	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	83.65	kJ/mol	Relay (1.0) Calculated Property
IE	8.19	eV	Relay (1.0) Calculated Property
log10WS	-4.47		Relay (1.0) Calculated Property
logPoct/wat	6.696		Crippen Calculated Property
Pc	877.11	kPa	Relay (1.0-beta) Calculated Property
Inp	[2106.00; 2106.00]
Inp	2106.00		NIST
Inp	2106.00		NIST
Tboil	599.28	K	Relay (1.0) Calculated Property
Tc	851.28	K	Relay (1.0) Calculated Property
Tfus	375.46	K	Relay (1.0) Calculated Property
Vc	1.694	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to N-Acetyl-L-aspartic acid, N-(tert-butyldimethylsilyl)-, bis(tert-butyldimethylsilyl) 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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