Chemical Properties of 3,3,5-Trimethylcyclohexan-1-ol, tert-butyldimethylsilyl ether

InChI

InChI=1S/C15H32OSi/c1-12-9-13(11-15(5,6)10-12)16-17(7,8)14(2,3)4/h12-13H,9-11H2,1-8H3

InChI Key

JVSGPFILWCVGCG-UHFFFAOYSA-N

Formula

C15H32OSi

SMILES

CC1CC(O[Si](C)(C)C(C)(C)C)CC(C)(C)C1

Molecular Weight¹

256.50

Other Names

• Cyclohexanol, 3,3,5-trimethyl-, tert-butyldimethylsilyl- ether
• Cyclonol, tert-butyldimethylsilyl ether

• 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	0.4411		Relay (... Calculated Property
ΔfG°	2.81	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-547.11	kJ/mol	Relay (... Calculated Property
ΔvapH°	54.48	kJ/mol	Relay (... Calculated Property
IE	8.93	eV	Relay (... Calculated Property
log10WS	-4.38		Relay (... Calculated Property
logPoct/wat	5.223		Crippen Calculated Property
Pc	1689.33	kPa	Relay (... Calculated Property ⚠️
Inp	[1329.00; 1329.00]
Inp	1329.00		NIST
Inp	1329.00		NIST
Tboil	521.84	K	Relay (... Calculated Property
Tc	712.35	K	Relay (... Calculated Property
Tfus	268.23	K	Relay (... Calculated Property
Vc	0.889	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to 3,3,5-Trimethylcyclohexan-1-ol, 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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