Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, di(2-methylcyclohexyl) ester

InChI

InChI=1S/C22H36O4/c1-15-9-3-7-13-19(15)25-21(23)17-11-5-6-12-18(17)22(24)26-20-14-8-4-10-16(20)2/h15-20H,3-14H2,1-2H3

InChI Key

GWFUSSMLDJQXKE-UHFFFAOYSA-N

Formula

C22H36O4

SMILES

CC1CCCCC1OC(=O)C1CCCCC1C(=O)OC1CCCCC1C

Molecular Weight¹

364.52

• 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	0.6836		Relay (1.0) Calculated Property
ΔfG°	-283.26	kJ/mol	Joback Calculated Property
ΔfH°gas	-1052.17	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	37.03	kJ/mol	Joback Calculated Property
ΔvapH°	105.95	kJ/mol	Relay (1.0) Calculated Property
IE	9.35	eV	Relay (1.0) Calculated Property
log10WS	-5.26		Relay (1.0) Calculated Property
logPoct/wat	5.037		Crippen Calculated Property
McVol	303.140	ml/mol	McGowan Calculated Property
Pc	1349.66	kPa	Joback Calculated Property
Inp	[2561.00; 2561.00]
Inp	2561.00		NIST
Inp	2561.00		NIST
Tboil	665.22	K	Relay (1.0) Calculated Property
Tc	911.04	K	Relay (1.0) Calculated Property
Tfus	344.32	K	Relay (1.0) Calculated Property
Vc	1.105	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1094.72; 1186.62]	J/mol×K	[899.98; 1133.68]
Cp,gas	1094.72	J/mol×K	899.98	Joback Calculated Property
Cp,gas	1116.04	J/mol×K	938.93	Joback Calculated Property
Cp,gas	1134.92	J/mol×K	977.88	Joback Calculated Property
Cp,gas	1151.40	J/mol×K	1016.83	Joback Calculated Property
Cp,gas	1165.49	J/mol×K	1055.78	Joback Calculated Property
Cp,gas	1177.22	J/mol×K	1094.73	Joback Calculated Property
Cp,gas	1186.62	J/mol×K	1133.68	Joback Calculated Property
η	[0.0000981; 0.0012419]	Pa×s	[491.44; 899.98]
η	0.0012419	Pa×s	491.44	Joback Calculated Property
η	0.0006288	Pa×s	559.53	Joback Calculated Property
η	0.0003691	Pa×s	627.62	Joback Calculated Property
η	0.0002404	Pa×s	695.71	Joback Calculated Property
η	0.0001691	Pa×s	763.80	Joback Calculated Property
η	0.0001259	Pa×s	831.89	Joback Calculated Property
η	0.0000981	Pa×s	899.98	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, di(2-methylcyclohexyl) ester.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.