Chemical Properties of D-(-)-Citramalic acid, O-trimethylsilyl-, bis(trimethylsilyl) ester

InChI

InChI=1S/C14H32O5Si3/c1-14(19-22(8,9)10,13(16)18-21(5,6)7)11-12(15)17-20(2,3)4/h11H2,1-10H3

InChI Key

PQUDIQABDWAPQW-UHFFFAOYSA-N

Formula

C14H32O5Si3

SMILES

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

Molecular Weight¹

364.66

Other Names

• Bis(trimethylsilyl) (2S)-2-methyl-2-[(trimethylsilyl)oxy]succinate
• D-(-)-citramalic acid, 3tms 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	0.6761		Relay (... Calculated Property
ΔfG°	-555.00	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-1385.23	kJ/mol	Relay (... Calculated Property
ΔvapH°	65.35	kJ/mol	Relay (... Calculated Property
IE	9.80	eV	Relay (... Calculated Property
log10WS	-2.15		Relay (... Calculated Property
logPoct/wat	3.743		Crippen Calculated Property
Pc	770.42	kPa	Relay (... Calculated Property ⚠️
Inp	[1461.60; 1490.00]
Inp	1490.00		NIST
Inp	1490.00		NIST
Inp	1463.00		NIST
Inp	1461.60		NIST
Inp	1487.00		NIST
Inp	1487.00		NIST
Inp	1490.00		NIST
Inp	1463.00		NIST
Tboil	510.56	K	Relay (... Calculated Property
Tc	694.81	K	Relay (... Calculated Property
Tfus	296.31	K	Relay (... Calculated Property
Vc	1.201	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to D-(-)-Citramalic acid, O-trimethylsilyl-, bis(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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