Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, ethyl 2-methoxyethyl ester

InChI

InChI=1S/C13H22O5/c1-3-17-12(14)10-6-4-5-7-11(10)13(15)18-9-8-16-2/h10-11H,3-9H2,1-2H3

InChI Key

XPMUGQKGWZTHBO-UHFFFAOYSA-N

Formula

C13H22O5

SMILES

CCOC(=O)C1CCCCC1C(=O)OCCOC

Molecular Weight¹

258.31

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion 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.
• McVol : McGowan's characteristic volume (ml/mol).
• 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	0.6445		Relay (... Calculated Property
ΔfG°	-497.52	kJ/mol	Joback Calculated Property
ΔfH°gas	-980.02	kJ/mol	Relay (... Calculated Property
ΔfusH°	29.09	kJ/mol	Joback Calculated Property
ΔvapH°	81.67	kJ/mol	Relay (... Calculated Property
IE	9.54	eV	Relay (... Calculated Property
log10WS	-2.04		Relay (... Calculated Property
logPoct/wat	1.545		Crippen Calculated Property
McVol	203.920	ml/mol	McGowan Calculated Property
Pc	2030.89	kPa	Joback Calculated Property
Inp	[1750.00; 1750.00]
Inp	1750.00		NIST
Inp	1750.00		NIST
Tboil	571.43	K	Relay (... Calculated Property
Tc	770.62	K	Relay (... Calculated Property
Tfus	288.29	K	Relay (... Calculated Property
Vc	0.730	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[592.03; 681.91]	J/mol×K	[686.72; 887.19]
Cp,gas	592.03	J/mol×K	686.72	Joback Calculated Property
Cp,gas	609.63	J/mol×K	720.13	Joback Calculated Property
Cp,gas	626.21	J/mol×K	753.54	Joback Calculated Property
Cp,gas	641.73	J/mol×K	786.95	Joback Calculated Property
Cp,gas	656.20	J/mol×K	820.37	Joback Calculated Property
Cp,gas	669.60	J/mol×K	853.78	Joback Calculated Property
Cp,gas	681.91	J/mol×K	887.19	Joback Calculated Property
η	[0.0001329; 0.0013073]	Pa×s	[405.96; 686.72]
η	0.0013073	Pa×s	405.96	Joback Calculated Property
η	0.0007336	Pa×s	452.75	Joback Calculated Property
η	0.0004587	Pa×s	499.55	Joback Calculated Property
η	0.0003108	Pa×s	546.34	Joback Calculated Property
η	0.0002239	Pa×s	593.13	Joback Calculated Property
η	0.0001693	Pa×s	639.93	Joback Calculated Property
η	0.0001329	Pa×s	686.72	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, ethyl 2-methoxyethyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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