Chemical Properties of 2,3-Dimethylphenol, tert-butyldimethylsilyl ether

InChI

InChI=1S/C14H24OSi/c1-11-9-8-10-13(12(11)2)15-16(6,7)14(3,4)5/h8-10H,1-7H3

InChI Key

HNFBPICGQRTYTN-UHFFFAOYSA-N

Formula

C14H24OSi

SMILES

Cc1cccc(O[Si](C)(C)C(C)(C)C)c1C

Molecular Weight¹

236.43

Other Names

• 2,3-Dimethylphenol, tbdms 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	0.4708		Relay (... Calculated Property
ΔfG°	53.90	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-350.53	kJ/mol	Relay (... Calculated Property
ΔvapH°	59.05	kJ/mol	Relay (... Calculated Property
IE	8.10	eV	Relay (... Calculated Property
log10WS	-3.94		Relay (... Calculated Property
logPoct/wat	4.687		Crippen Calculated Property
Pc	1927.93	kPa	Relay (... Calculated Property ⚠️
Inp	[1501.20; 1501.20]
Inp	1501.20		NIST
Inp	1501.20		NIST
Tboil	531.45	K	Relay (... Calculated Property
Tc	745.50	K	Relay (... Calculated Property
Tfus	315.68	K	Relay (... Calculated Property
Vc	0.775	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to 2,3-Dimethylphenol, tert-butyldimethylsilyl 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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