Chemical Properties of (E)-N-tert-Butyldimethylsilyloxy-1-(4-methoxy-3-nitrophenyl)ethanimine

InChI

InChI=1S/C15H24N2O4Si/c1-11(16-21-22(6,7)15(2,3)4)12-8-9-14(20-5)13(10-12)17(18)19/h8-10H,1-7H3

InChI Key

CJCLIVFAMRNPMM-UHFFFAOYSA-N

Formula

C15H24N2O4Si

SMILES

COc1ccc(C(C)=NO[Si](C)(C)C(C)(C)C)cc1[N+](=O)[O-]

Molecular Weight¹

324.45

• 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	0.7911		Relay (... Calculated Property
ΔfG°	163.46	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-295.21	kJ/mol	Relay (... Calculated Property
ΔvapH°	78.16	kJ/mol	Relay (... Calculated Property
IE	7.85	eV	Relay (... Calculated Property
log10WS	-4.51		Relay (... Calculated Property
logPoct/wat	4.349		Crippen Calculated Property
Pc	1632.61	kPa	Relay (... Calculated Property ⚠️
Inp	[2267.00; 2267.00]
Inp	2267.00		NIST
Inp	2267.00		NIST
Tboil	602.64	K	Relay (... Calculated Property
Tc	866.29	K	Relay (... Calculated Property
Tfus	401.07	K	Relay (... Calculated Property
Vc	0.915	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to (E)-N-tert-Butyldimethylsilyloxy-1-(4-methoxy-3-nitrophenyl)ethanimine.

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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