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

InChI

InChI=1S/C26H50O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-29-26(27)24-19-21-25(28-2)22-20-24/h24-25H,3-23H2,1-2H3

InChI Key

QQDXETMFWIDADB-UHFFFAOYSA-N

Formula

C26H50O3

SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1CCC(OC)CC1

Molecular Weight¹

410.68

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	61.56	kJ/mol	Joback Calculated Property
ΔvapH°	123.10	kJ/mol	Relay (1.0) Calculated Property
log10WS	-7.25		Relay (1.0) Calculated Property
logPoct/wat	7.996		Crippen Calculated Property
McVol	379.650	ml/mol	McGowan Calculated Property
Pc	791.71	kPa	Joback Calculated Property
Inp	[2980.00; 2980.00]
Inp	2980.00		NIST
Inp	2980.00		NIST
Tboil	668.30	K	Relay (1.0) Calculated Property
Tc	878.34	K	Relay (1.0) Calculated Property
Tfus	315.84	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1311.59; 1421.28]	J/mol×K	[890.00; 1089.63]
Cp,gas	1311.59	J/mol×K	890.00	Joback Calculated Property
Cp,gas	1333.87	J/mol×K	923.27	Joback Calculated Property
Cp,gas	1354.51	J/mol×K	956.54	Joback Calculated Property
Cp,gas	1373.53	J/mol×K	989.81	Joback Calculated Property
Cp,gas	1390.97	J/mol×K	1023.09	Joback Calculated Property
Cp,gas	1406.88	J/mol×K	1056.36	Joback Calculated Property
Cp,gas	1421.28	J/mol×K	1089.63	Joback Calculated Property
η	[0.0000272; 0.0008576]	Pa×s	[450.48; 890.00]
η	0.0008576	Pa×s	450.48	Joback Calculated Property
η	0.0003228	Pa×s	523.73	Joback Calculated Property
η	0.0001544	Pa×s	596.99	Joback Calculated Property
η	0.0000868	Pa×s	670.24	Joback Calculated Property
η	0.0000547	Pa×s	743.49	Joback Calculated Property
η	0.0000374	Pa×s	816.75	Joback Calculated Property
η	0.0000272	Pa×s	890.00	Joback Calculated Property

Similar Compounds

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