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

InChI

InChI=1S/C16H30O3/c1-3-4-5-6-7-8-13-19-16(17)14-9-11-15(18-2)12-10-14/h14-15H,3-13H2,1-2H3

InChI Key

PQCARJULYDCJSR-UHFFFAOYSA-N

Formula

C16H30O3

SMILES

CCCCCCCCOC(=O)C1CCC(OC)CC1

Molecular Weight¹

270.41

• 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	0.7229		Relay (... Calculated Property
ΔfG°	-238.34	kJ/mol	Joback Calculated Property
ΔfH°gas	-725.08	kJ/mol	Relay (... Calculated Property
ΔfusH°	34.08	kJ/mol	Joback Calculated Property
ΔvapH°	79.38	kJ/mol	Relay (... Calculated Property
IE	9.24	eV	Relay (... Calculated Property
log10WS	-3.72		Relay (... Calculated Property
logPoct/wat	4.095		Crippen Calculated Property
McVol	238.750	ml/mol	McGowan Calculated Property
Pc	1534.26	kPa	Joback Calculated Property
Inp	[1945.00; 1945.00]
Inp	1945.00		NIST
Inp	1945.00		NIST
Tboil	595.12	K	Relay (... Calculated Property
Tc	791.70	K	Relay (... Calculated Property
Tfus	277.44	K	Relay (... Calculated Property
Vc	0.883	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[703.83; 810.41]	J/mol×K	[679.07; 868.14]
Cp,gas	703.83	J/mol×K	679.07	Joback Calculated Property
Cp,gas	724.26	J/mol×K	710.58	Joback Calculated Property
Cp,gas	743.61	J/mol×K	742.09	Joback Calculated Property
Cp,gas	761.90	J/mol×K	773.61	Joback Calculated Property
Cp,gas	779.12	J/mol×K	805.12	Joback Calculated Property
Cp,gas	795.29	J/mol×K	836.63	Joback Calculated Property
Cp,gas	810.41	J/mol×K	868.14	Joback Calculated Property
η	[0.0001199; 0.0018288]	Pa×s	[367.61; 679.07]
η	0.0018288	Pa×s	367.61	Joback Calculated Property
η	0.0008768	Pa×s	419.52	Joback Calculated Property
η	0.0004943	Pa×s	471.43	Joback Calculated Property
η	0.0003122	Pa×s	523.34	Joback Calculated Property
η	0.0002142	Pa×s	575.25	Joback Calculated Property
η	0.0001565	Pa×s	627.16	Joback Calculated Property
η	0.0001199	Pa×s	679.07	Joback Calculated Property

Similar Compounds

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

Sources

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

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