Chemical Properties of 7-Chloro-3-methyl-quinoline-8-carboxylic acid, trimethylsilyl ester

InChI

InChI=1S/C14H16ClNO2Si/c1-9-7-10-5-6-11(15)12(13(10)16-8-9)14(17)18-19(2,3)4/h5-8H,1-4H3

InChI Key

RZKLOMAGUBRKRV-UHFFFAOYSA-N

Formula

C14H16ClNO2Si

SMILES

Cc1cnc2c(C(=O)O[Si](C)(C)C)c(Cl)ccc2c1

Molecular Weight¹

293.82

Other Names

• 8-Quinolinecarboxylic acid, 7-chloro-3-methyl-, trimethylsilyl ester
• 7-Chloro-3-methyl-quinoline-8-carboxylic acid, trimethylsilyl 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	0.6500		Relay (1.0) Calculated Property
ΔfG°	-46.95	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-405.30	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	86.15	kJ/mol	Relay (1.0) Calculated Property
IE	8.53	eV	Relay (1.0) Calculated Property
log10WS	-4.10		Relay (1.0) Calculated Property
logPoct/wat	4.188		Crippen Calculated Property
Pc	1673.56	kPa	Relay (1.0-beta) Calculated Property
Inp	[2090.00; 2090.00]
Inp	2090.00		NIST
Inp	2090.00		NIST
Tboil	623.03	K	Relay (1.0) Calculated Property
Tc	881.17	K	Relay (1.0) Calculated Property
Tfus	351.44	K	Relay (1.0) Calculated Property
Vc	0.819	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 7-Chloro-3-methyl-quinoline-8-carboxylic acid, trimethylsilyl ester.

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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