Chemical Properties of Phenol, 2,2'-methylenebis[4-methyl- , TMS

InChI

InChI=1S/C21H32O2Si2/c1-16-9-11-20(22-24(3,4)5)18(13-16)15-19-14-17(2)10-12-21(19)23-25(6,7)8/h9-14H,15H2,1-8H3

InChI Key

JEHSZOCETJIKGI-UHFFFAOYSA-N

Formula

C21H32O2Si2

SMILES

Cc1ccc(O[Si](C)(C)C)c(Cc2cc(C)ccc2O[Si](C)(C)C)c1

Molecular Weight¹

372.65

• 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	0.7450		Relay (1.0) Calculated Property
ΔfG°	38.73	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-532.12	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	91.31	kJ/mol	Relay (1.0) Calculated Property
IE	8.16	eV	Relay (1.0) Calculated Property
log10WS	-5.57		Relay (1.0) Calculated Property
logPoct/wat	6.322		Crippen Calculated Property
Pc	708.68	kPa	Relay (1.0-beta) Calculated Property
Inp	[2070.00; 2070.00]
Inp	2070.00		NIST
Inp	2070.00		NIST
Tboil	641.80	K	Relay (1.0) Calculated Property
Tc	853.93	K	Relay (1.0) Calculated Property
Tfus	363.02	K	Relay (1.0) Calculated Property
Vc	1.222	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Phenol, 2,2'-methylenebis[4-methyl- , TMS.

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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