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

InChI

InChI=1S/C23H44O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-26-23(24)21-16-18-22(25-2)19-17-21/h21-22H,3-20H2,1-2H3

InChI Key

OUQFWRFMFWNXKB-UHFFFAOYSA-N

Formula

C23H44O3

SMILES

CCCCCCCCCCCCCCCOC(=O)C1CCC(OC)CC1

Molecular Weight¹

368.59

• 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°	53.79	kJ/mol	Joback Calculated Property
ΔvapH°	110.58	kJ/mol	Relay (1.0) Calculated Property
log10WS	-6.24		Relay (1.0) Calculated Property
logPoct/wat	6.826		Crippen Calculated Property
McVol	337.380	ml/mol	McGowan Calculated Property
Pc	937.49	kPa	Joback Calculated Property
Inp	[2673.00; 2673.00]
Inp	2673.00		NIST
Inp	2673.00		NIST
Tboil	648.83	K	Relay (1.0) Calculated Property
Tc	856.69	K	Relay (1.0) Calculated Property
Tfus	307.98	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	[1119.18; 1228.91]	J/mol×K	[821.36; 1010.09]
Cp,gas	1119.18	J/mol×K	821.36	Joback Calculated Property
Cp,gas	1140.90	J/mol×K	852.81	Joback Calculated Property
Cp,gas	1161.21	J/mol×K	884.27	Joback Calculated Property
Cp,gas	1180.15	J/mol×K	915.72	Joback Calculated Property
Cp,gas	1197.73	J/mol×K	947.18	Joback Calculated Property
Cp,gas	1213.97	J/mol×K	978.63	Joback Calculated Property
Cp,gas	1228.91	J/mol×K	1010.09	Joback Calculated Property
η	[0.0000423; 0.0012514]	Pa×s	[416.67; 821.36]
η	0.0012514	Pa×s	416.67	Joback Calculated Property
η	0.0004802	Pa×s	484.12	Joback Calculated Property
η	0.0002329	Pa×s	551.57	Joback Calculated Property
η	0.0001323	Pa×s	619.01	Joback Calculated Property
η	0.0000839	Pa×s	686.46	Joback Calculated Property
η	0.0000578	Pa×s	753.91	Joback Calculated Property
η	0.0000423	Pa×s	821.36	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexanecarboxylic acid, 4-methoxy-, pentadecyl 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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