Chemical Properties of Acetophenone, 4-hydroxy-3-methoxy, oxime, bis-TMS

InChI

InChI=1S/C15H27NO3Si2/c1-12(16-19-21(6,7)8)13-9-10-14(15(11-13)17-2)18-20(3,4)5/h9-11H,1-8H3/b16-12-

InChI Key

CUHGNLCZOBUSCD-VBKFSLOCSA-N

Formula

C15H27NO3Si2

SMILES

COc1cc(C(C)=NO[Si](C)(C)C)ccc1O[Si](C)(C)C

Molecular Weight¹

325.55

• 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	0.7493		Relay (1.0) Calculated Property
ΔfG°	-16.79	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-536.66	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	71.30	kJ/mol	Relay (1.0) Calculated Property
IE	7.76	eV	Relay (1.0) Calculated Property
log10WS	-3.53		Relay (1.0) Calculated Property
logPoct/wat	4.484		Crippen Calculated Property
Pc	1032.20	kPa	Relay (1.0-beta) Calculated Property
Inp	[1805.00; 1805.00]
Inp	1805.00		NIST
Inp	1805.00		NIST
Tboil	582.00	K	Relay (1.0) Calculated Property
Tc	767.43	K	Relay (1.0) Calculated Property
Tfus	353.99	K	Relay (1.0) Calculated Property
Vc	1.039	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Acetophenone, 4-hydroxy-3-methoxy, oxime, bis-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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