Chemical Properties of Glucaric acid, 2,3,5-tris-O-(trimethylsilyl)-, «gamma»-lactone, 6-(trimethylsilyl) ester (CAS 56272-60-7)

InChI

InChI=1S/C18H40O7Si4/c1-26(2,3)22-14-13(21-17(19)16(14)24-28(7,8)9)15(23-27(4,5)6)18(20)25-29(10,11)12/h13-16H,1-12H3

InChI Key

ZEVFIEFYBHUBDV-UHFFFAOYSA-N

Formula

C18H40O7Si4

SMILES

C[Si](C)(C)OC(=O)C(O[Si](C)(C)C)C1OC(=O)C(O[Si](C)(C)C)C1O[Si](C)(C)C

Molecular Weight¹

480.85

CAS

56272-60-7

Other Names

• Glucaric acid, 2,3,5,6-tetrakis-O-(trimethylsilyl)-, 1,4-lactone, 6-(trimethylsilyl) ester
• Gluconic acid, 2,3,5,6-tetrakis-O-(trimethylsilyl)-, lactone
• Glucaric acid, 1,4-lactone, 4TMS

• 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	0.7418		Relay (1.0) Calculated Property
ΔfG°	-728.65	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-1746.09	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	83.04	kJ/mol	Relay (1.0) Calculated Property
IE	9.83	eV	Relay (1.0) Calculated Property
log10WS	-2.55		Relay (1.0) Calculated Property
logPoct/wat	3.950		Crippen Calculated Property
Pc	234.25	kPa	Relay (1.0-beta) Calculated Property
Inp	[1940.00; 1940.00]
Inp	1940.00		NIST
Inp	1940.00		NIST
Tboil	591.38	K	Relay (1.0) Calculated Property
Tc	773.94	K	Relay (1.0) Calculated Property
Tfus	323.66	K	Relay (1.0) Calculated Property
Vc	1.512	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Glucaric acid, 2,3,5-tris-O-(trimethylsilyl)-, «gamma»-lactone, 6-(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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