Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, dicyclohexyl ester

InChI

InChI=1S/C20H32O4/c21-19(23-15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)24-16-11-5-2-6-12-16/h15-18H,1-14H2

InChI Key

VKPGBQAXQBOSCY-UHFFFAOYSA-N

Formula

C20H32O4

SMILES

O=C(OC1CCCCC1)C1CCCCC1C(=O)OC1CCCCC1

Molecular Weight¹

336.47

• 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	0.6742		Relay (... Calculated Property
ΔfG°	-284.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-988.95	kJ/mol	Relay (... Calculated Property
ΔfusH°	29.71	kJ/mol	Joback Calculated Property
ΔvapH°	105.24	kJ/mol	Relay (... Calculated Property
IE	9.47	eV	Relay (... Calculated Property
log10WS	-4.85		Relay (... Calculated Property
logPoct/wat	4.545		Crippen Calculated Property
McVol	274.960	ml/mol	McGowan Calculated Property
Pc	1647.09	kPa	Joback Calculated Property
Inp	[2480.00; 2480.00]
Inp	2480.00		NIST
Inp	2480.00		NIST
Tboil	652.04	K	Relay (... Calculated Property
Tc	907.89	K	Relay (... Calculated Property
Tfus	355.75	K	Relay (... Calculated Property
Vc	1.012	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[963.67; 1059.51]	J/mol×K	[863.56; 1103.01]
Cp,gas	963.67	J/mol×K	863.56	Joback Calculated Property
Cp,gas	985.27	J/mol×K	903.47	Joback Calculated Property
Cp,gas	1004.56	J/mol×K	943.38	Joback Calculated Property
Cp,gas	1021.60	J/mol×K	983.28	Joback Calculated Property
Cp,gas	1036.41	J/mol×K	1023.19	Joback Calculated Property
Cp,gas	1049.03	J/mol×K	1063.10	Joback Calculated Property
Cp,gas	1059.51	J/mol×K	1103.01	Joback Calculated Property
η	[0.0000760; 0.0013290]	Pa×s	[477.38; 863.56]
η	0.0013290	Pa×s	477.38	Joback Calculated Property
η	0.0006213	Pa×s	541.74	Joback Calculated Property
η	0.0003414	Pa×s	606.11	Joback Calculated Property
η	0.0002104	Pa×s	670.47	Joback Calculated Property
η	0.0001412	Pa×s	734.83	Joback Calculated Property
η	0.0001010	Pa×s	799.20	Joback Calculated Property
η	0.0000760	Pa×s	863.56	Joback Calculated Property

Similar Compounds

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

Sources

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

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