Chemical Properties of 2-Octanol, tert-butyldimethylsilyl ether

InChI

InChI=1S/C14H32OSi/c1-8-9-10-11-12-13(2)15-16(6,7)14(3,4)5/h13H,8-12H2,1-7H3

InChI Key

HIZXTVSBHWSMLS-UHFFFAOYSA-N

Formula

C14H32OSi

SMILES

CCCCCCC(C)O[Si](C)(C)C(C)(C)C

Molecular Weight¹

244.50

• 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).
• 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	0.5494		Relay (1.0) Calculated Property
ΔfG°	-28.97	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-550.91	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	54.56	kJ/mol	Relay (1.0) Calculated Property
IE	9.04	eV	Relay (1.0) Calculated Property
logPoct/wat	5.367		Crippen Calculated Property
Pc	1644.22	kPa	Relay (1.0-beta) Calculated Property
Inp	[1317.70; 1317.70]
Inp	1317.70		NIST
Inp	1317.70		NIST
Tboil	503.18	K	Relay (1.0) Calculated Property
Tc	670.74	K	Relay (1.0) Calculated Property
Tfus	227.33	K	Relay (1.0) Calculated Property
Vc	0.891	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Similar Compounds

Find more compounds similar to 2-Octanol, 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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