Chemical Properties of Methylephedrine, trimethylsilyl ether

InChI

InChI=1S/C14H25NOSi/c1-12(15(2)3)14(16-17(4,5)6)13-10-8-7-9-11-13/h7-12,14H,1-6H3

InChI Key

VXFCGGGONKKHJP-UHFFFAOYSA-N

Formula

C14H25NOSi

SMILES

CC(C(O[Si](C)(C)C)c1ccccc1)N(C)C

Molecular Weight¹

251.44

• 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	0.4624		Relay (1.0) Calculated Property
ΔfG°	133.03	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-252.36	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	67.55	kJ/mol	Relay (1.0) Calculated Property
IE	8.18	eV	Relay (1.0) Calculated Property
log10WS	-1.38		Relay (1.0) Calculated Property
logPoct/wat	3.529		Crippen Calculated Property
Pc	1673.07	kPa	Relay (1.0-beta) Calculated Property
Inp	[1417.00; 1417.00]
Inp	1417.00		NIST
Inp	1417.00		NIST
Tboil	528.49	K	Relay (1.0) Calculated Property
Tc	721.27	K	Relay (1.0) Calculated Property
Tfus	290.82	K	Relay (1.0) Calculated Property
Vc	0.823	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Methylephedrine, trimethylsilyl 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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