Chemical Properties of 2-C-Methylerythronic acid, tris-TMS

InChI

InChI=1S/C17H42O5Si4/c1-17(22-26(11,12)13,16(18)21-25(8,9)10)15(20-24(5,6)7)14-19-23(2,3)4/h15H,14H2,1-13H3/t15?,17-/m1/s1

InChI Key

UZLWHXGOWNGVDE-OMOCHNIRSA-N

Formula

C17H42O5Si4

SMILES

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

Molecular Weight¹

438.85

• 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	0.6964		Relay (1.0) Calculated Property
ΔfG°	-505.74	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-1466.74	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	65.37	kJ/mol	Relay (1.0) Calculated Property
IE	9.60	eV	Relay (1.0) Calculated Property
log10WS	-2.65		Relay (1.0) Calculated Property
logPoct/wat	5.046		Crippen Calculated Property
Pc	356.57	kPa	Relay (1.0-beta) Calculated Property
Inp	[1626.00; 1626.00]
Inp	1626.00		NIST
Inp	1626.00		NIST
Tboil	546.09	K	Relay (1.0) Calculated Property
Tc	710.73	K	Relay (1.0) Calculated Property
Tfus	272.10	K	Relay (1.0) Calculated Property
Vc	1.481	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 2-C-Methylerythronic acid, tris-TMS.

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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