Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl undecyl ester

InChI

InChI=1S/C25H37FO4/c1-2-3-4-5-6-7-8-9-14-19-29-24(27)20-15-10-11-16-21(20)25(28)30-23-18-13-12-17-22(23)26/h12-13,17-18,20-21H,2-11,14-16,19H2,1H3

InChI Key

ODKBUQDUYAWVPP-UHFFFAOYSA-N

Formula

C25H37FO4

SMILES

CCCCCCCCCCCOC(=O)C1CCCCC1C(=O)Oc1ccccc1F

Molecular Weight¹

420.56

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization 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	[1187.55; 1262.14]	J/mol×K	[969.79; 1188.87]
Cp,gas	1187.55	J/mol×K	969.79	Joback Calculated Property
Cp,gas	1204.12	J/mol×K	1006.30	Joback Calculated Property
Cp,gas	1218.97	J/mol×K	1042.82	Joback Calculated Property
Cp,gas	1232.16	J/mol×K	1079.33	Joback Calculated Property
Cp,gas	1243.72	J/mol×K	1115.84	Joback Calculated Property
Cp,gas	1253.70	J/mol×K	1152.36	Joback Calculated Property
Cp,gas	1262.14	J/mol×K	1188.87	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl undecyl ester.

Sources

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

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