Chemical Properties of Methylcitric acid, tetrakis(trimethylsilyl) deriv.

InChI

InChI=1S/C19H42O7Si4/c1-14(17(20)24-28(5,6)7)15(18(21)25-29(8,9)10)16(23-27(2,3)4)19(22)26-30(11,12)13/h14-16H,1-13H3

InChI Key

PJGUFNNMVFUWFQ-UHFFFAOYSA-N

Formula

C19H42O7Si4

SMILES

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

Molecular Weight¹

494.87

• 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	0.8219		Relay (... Calculated Property
ΔfG°	-746.44	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-1846.74	kJ/mol	Relay (... Calculated Property
ΔvapH°	76.50	kJ/mol	Relay (... Calculated Property
IE	9.98	eV	Relay (... Calculated Property
log10WS	-2.70		Relay (... Calculated Property
logPoct/wat	4.593		Crippen Calculated Property
Pc	173.98	kPa	Relay (... Calculated Property ⚠️
Inp	[1866.00; 1866.00]
Inp	1866.00		NIST
Inp	1866.00		NIST
Tboil	549.89	K	Relay (... Calculated Property
Tc	741.24	K	Relay (... Calculated Property
Tfus	316.70	K	Relay (... Calculated Property
Vc	1.566	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to Methylcitric acid, tetrakis(trimethylsilyl) deriv..

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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