Chemical Properties of 2-Hydroxythiophenol, S-trimethylsilyl-, trimethylsilyl ether

InChI

InChI=1S/C12H22OSSi2/c1-15(2,3)13-11-9-7-8-10-12(11)14-16(4,5)6/h7-10H,1-6H3

InChI Key

HBFIGIZBOXNZBE-UHFFFAOYSA-N

Formula

C12H22OSSi2

SMILES

C[Si](C)(C)Oc1ccccc1S[Si](C)(C)C

Molecular Weight¹

270.54

Other Names

• 2-Mercaptophenol, 2tms derivative

• 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	0.4476		Relay (1.0) Calculated Property
ΔfG°	25.75	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-393.34	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	61.26	kJ/mol	Relay (1.0) Calculated Property
IE	8.43	eV	Relay (1.0) Calculated Property
log10WS	-3.95		Relay (1.0) Calculated Property
logPoct/wat	4.827		Crippen Calculated Property
Pc	1490.92	kPa	Relay (1.0-beta) Calculated Property
Inp	[1468.60; 1468.60]
Inp	1468.60		NIST
Inp	1468.60		NIST
Tboil	539.18	K	Relay (1.0) Calculated Property
Tc	725.32	K	Relay (1.0) Calculated Property
Tfus	308.46	K	Relay (1.0) Calculated Property
Vc	0.854	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 2-Hydroxythiophenol, S-trimethylsilyl-, 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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