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

InChI

InChI=1S/C29H54O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-33-28(30)26-21-18-19-22-27(26)29(31)34-25-24-32-2/h26-27H,3-25H2,1-2H3

InChI Key

PCCYWPXTIMBIKC-UHFFFAOYSA-N

Formula

C29H54O5

SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1CCCCC1C(=O)OCCOC

Molecular Weight¹

482.74

• 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	1.2385		Relay (1.0) Calculated Property
ΔfG°	-362.80	kJ/mol	Joback Calculated Property
ΔfH°gas	-1299.35	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	70.53	kJ/mol	Joback Calculated Property
ΔvapH°	136.49	kJ/mol	Relay (1.0) Calculated Property
IE	9.82	eV	Relay (1.0) Calculated Property
log10WS	-7.38		Relay (1.0) Calculated Property
logPoct/wat	7.787		Crippen Calculated Property
McVol	429.360	ml/mol	McGowan Calculated Property
Pc	709.22	kPa	Joback Calculated Property
Inp	[3383.00; 3383.00]
Inp	3383.00		NIST
Inp	3383.00		NIST
Tboil	693.63	K	Relay (1.0) Calculated Property
Tc	900.01	K	Relay (1.0) Calculated Property
Tfus	324.77	K	Relay (1.0) Calculated Property
Vc	1.598	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1569.61; 1648.65]	J/mol×K	[1052.80; 1303.51]
Cp,gas	1569.61	J/mol×K	1052.80	Joback Calculated Property
Cp,gas	1589.34	J/mol×K	1094.58	Joback Calculated Property
Cp,gas	1606.36	J/mol×K	1136.37	Joback Calculated Property
Cp,gas	1620.75	J/mol×K	1178.15	Joback Calculated Property
Cp,gas	1632.55	J/mol×K	1219.94	Joback Calculated Property
Cp,gas	1641.83	J/mol×K	1261.72	Joback Calculated Property
Cp,gas	1648.65	J/mol×K	1303.51	Joback Calculated Property
η	[0.0000136; 0.0002368]	Pa×s	[586.28; 1052.80]
η	0.0002368	Pa×s	586.28	Joback Calculated Property
η	0.0001114	Pa×s	664.03	Joback Calculated Property
η	0.0000614	Pa×s	741.79	Joback Calculated Property
η	0.0000379	Pa×s	819.54	Joback Calculated Property
η	0.0000254	Pa×s	897.29	Joback Calculated Property
η	0.0000182	Pa×s	975.05	Joback Calculated Property
η	0.0000136	Pa×s	1052.80	Joback Calculated Property

Similar Compounds

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

Sources

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

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