Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, 2-ethoxyethyl octyl ester

InChI

InChI=1S/C20H36O5/c1-3-5-6-7-8-11-14-24-19(21)17-12-9-10-13-18(17)20(22)25-16-15-23-4-2/h17-18H,3-16H2,1-2H3

InChI Key

ZBOOSQLTKNKYFY-UHFFFAOYSA-N

Formula

C20H36O5

SMILES

CCCCCCCCOC(=O)C1CCCCC1C(=O)OCCOCC

Molecular Weight¹

356.50

• 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).
• 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
ΔfG°	-438.58	kJ/mol	Joback Calculated Property
ΔfH°gas	-1043.97	kJ/mol	Joback Calculated Property
ΔfusH°	47.22	kJ/mol	Joback Calculated Property
ΔvapH°	80.96	kJ/mol	Joback Calculated Property
log10WS	-4.42		Crippen Calculated Property
logPoct/wat	4.276		Crippen Calculated Property
McVol	302.550	ml/mol	McGowan Calculated Property
Pc	1196.48	kPa	Joback Calculated Property
Inp	[2390.00; 2390.00]
Inp	2390.00		NIST
Inp	2390.00		NIST
Tboil	846.88	K	Joback Calculated Property
Tc	1043.91	K	Joback Calculated Property
Tfus	484.85	K	Joback Calculated Property
Vc	1.153	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1001.22; 1092.41]	J/mol×K	[846.88; 1043.91]
Cp,gas	1001.22	J/mol×K	846.88	Joback Calculated Property
Cp,gas	1019.91	J/mol×K	879.72	Joback Calculated Property
Cp,gas	1037.20	J/mol×K	912.56	Joback Calculated Property
Cp,gas	1053.09	J/mol×K	945.40	Joback Calculated Property
Cp,gas	1067.58	J/mol×K	978.23	Joback Calculated Property
Cp,gas	1080.68	J/mol×K	1011.07	Joback Calculated Property
Cp,gas	1092.41	J/mol×K	1043.91	Joback Calculated Property
η	[0.0000531; 0.0007025]	Pa×s	[484.85; 846.88]
η	0.0007025	Pa×s	484.85	Joback Calculated Property
η	0.0003600	Pa×s	545.19	Joback Calculated Property
η	0.0002108	Pa×s	605.53	Joback Calculated Property
η	0.0001360	Pa×s	665.87	Joback Calculated Property
η	0.0000943	Pa×s	726.20	Joback Calculated Property
η	0.0000692	Pa×s	786.54	Joback Calculated Property
η	0.0000531	Pa×s	846.88	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-ethoxyethyl octyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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