Chemical Properties of D-Glucuronic acid, 2,3,4,5-tetrakis-O-(trimethylsilyl)-, trimethylsilyl ester (CAS 55530-80-8)

InChI

InChI=1S/C21H50O7Si5/c1-29(2,3)24-17(16-22)18(25-30(4,5)6)19(26-31(7,8)9)20(27-32(10,11)12)21(23)28-33(13,14)15/h16-20H,1-15H3

InChI Key

HDGFBGPNRURMOV-UHFFFAOYSA-N

Formula

C21H50O7Si5

SMILES

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

Molecular Weight¹

555.04

CAS

55530-80-8

Other Names

• D-Glucuronic acid, (5TMS)
• Glucuronic acid, penta-TMS
• D-Glucuronic acid, penta-TMS
• Glucuronic acid, penta-TMS, #2
• Glucuronic acid, penta-TMS, #1
• D-Glucuronic acid, TMS

• 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.
• 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	0.8197		Relay (1.0) Calculated Property
ΔfG°	-666.41	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-1858.03	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	78.28	kJ/mol	Relay (1.0) Calculated Property
IE	9.56	eV	Relay (1.0) Calculated Property
log10WS	-2.87		Relay (1.0) Calculated Property
logPoct/wat	5.444		Crippen Calculated Property
Inp	[2004.00; 2063.00]
Inp	2013.00		NIST
Inp	2018.00		NIST
Inp	2010.00		NIST
Inp	2010.00		NIST
Inp	2020.00		NIST
Inp	2004.00		NIST
Inp	2056.00		NIST
Inp	2008.00		NIST
Inp	2063.00		NIST
Tboil	603.43	K	Relay (1.0) Calculated Property
Tc	759.90	K	Relay (1.0) Calculated Property
Tfus	310.42	K	Relay (1.0) Calculated Property
Vc	1.797	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to D-Glucuronic acid, 2,3,4,5-tetrakis-O-(trimethylsilyl)-, 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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