Chemical Properties of Phloroglucinol, trimethylsilyl ether

InChI

InChI=1S/C9H14O3Si/c1-13(2,3)12-9-5-7(10)4-8(11)6-9/h4-6,10-11H,1-3H3

InChI Key

RJXUTCQDDWSLEZ-UHFFFAOYSA-N

Formula

C9H14O3Si

SMILES

C[Si](C)(C)Oc1cc(O)cc(O)c1

Molecular Weight¹

198.29

• 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	0.7010		Relay (1.0) Calculated Property
ΔfG°	-265.81	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-600.36	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	89.43	kJ/mol	Relay (1.0) Calculated Property
IE	8.46	eV	Relay (1.0) Calculated Property
log10WS	-2.37		Relay (1.0) Calculated Property
logPoct/wat	2.311		Crippen Calculated Property
Pc	2916.35	kPa	Relay (1.0-beta) Calculated Property
Inp	[1633.00; 1633.00]
Inp	1633.00		NIST
Inp	1633.00		NIST
Tboil	565.83	K	Relay (1.0) Calculated Property
Tc	765.95	K	Relay (1.0) Calculated Property
Tfus	407.64	K	Relay (1.0) Calculated Property
Vc	0.564	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Phloroglucinol, trimethylsilyl ether.

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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