Chemical Properties of Cyclohexanecarboxylic acid, 4-methoxy-, hexadecyl ester

InChI

InChI=1S/C24H46O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-27-24(25)22-17-19-23(26-2)20-18-22/h22-23H,3-21H2,1-2H3

InChI Key

GCCYIZQARKLHMY-UHFFFAOYSA-N

Formula

C24H46O3

SMILES

CCCCCCCCCCCCCCCCOC(=O)C1CCC(OC)CC1

Molecular Weight¹

382.62

• 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	1.0092		Relay (... Calculated Property
ΔfG°	-170.98	kJ/mol	Joback Calculated Property
ΔfH°gas	-889.05	kJ/mol	Relay (... Calculated Property
ΔfusH°	54.80	kJ/mol	Joback Calculated Property
ΔvapH°	112.96	kJ/mol	Relay (... Calculated Property
IE	9.50	eV	Relay (... Calculated Property
log10WS	-6.59		Relay (... Calculated Property
logPoct/wat	7.216		Crippen Calculated Property
McVol	351.470	ml/mol	McGowan Calculated Property
Pc	906.70	kPa	Joback Calculated Property
Inp	[2776.00; 2776.00]
Inp	2776.00		NIST
Inp	2776.00		NIST
Tboil	655.33	K	Relay (... Calculated Property
Tc	861.19	K	Relay (... Calculated Property
Tfus	315.77	K	Relay (... Calculated Property
Vc	1.322	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1193.07; 1301.85]	J/mol×K	[862.11; 1057.03]
Cp,gas	1193.07	J/mol×K	862.11	Joback Calculated Property
Cp,gas	1214.79	J/mol×K	894.60	Joback Calculated Property
Cp,gas	1235.04	J/mol×K	927.08	Joback Calculated Property
Cp,gas	1253.84	J/mol×K	959.57	Joback Calculated Property
Cp,gas	1271.23	J/mol×K	992.06	Joback Calculated Property
Cp,gas	1287.22	J/mol×K	1024.54	Joback Calculated Property
Cp,gas	1301.85	J/mol×K	1057.03	Joback Calculated Property
η	[0.0000418; 0.0008472]	Pa×s	[457.77; 862.11]
η	0.0008472	Pa×s	457.77	Joback Calculated Property
η	0.0003719	Pa×s	525.16	Joback Calculated Property
η	0.0001969	Pa×s	592.55	Joback Calculated Property
η	0.0001187	Pa×s	659.94	Joback Calculated Property
η	0.0000786	Pa×s	727.33	Joback Calculated Property
η	0.0000558	Pa×s	794.72	Joback Calculated Property
η	0.0000418	Pa×s	862.11	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexanecarboxylic acid, 4-methoxy-, hexadecyl ester.

Sources

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

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