Chemical Properties of Dimethylmalonic acid, pentafluorophenyl tetradecyl ester

InChI

InChI=1S/C25H35F5O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-33-23(31)25(2,3)24(32)34-22-20(29)18(27)17(26)19(28)21(22)30/h4-16H2,1-3H3

InChI Key

YFHXVOLSTZHXJG-UHFFFAOYSA-N

Formula

C25H35F5O4

SMILES

CCCCCCCCCCCCCCOC(=O)C(C)(C)C(=O)Oc1c(F)c(F)c(F)c(F)c1F

Molecular Weight¹

494.54

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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

Cheméo can also estimate Critical Volume, 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	[1213.22; 1290.70]	J/mol×K	[968.68; 1191.75]
Cp,gas	1213.22	J/mol×K	968.68	Joback Calculated Property
Cp,gas	1229.73	J/mol×K	1005.86	Joback Calculated Property
Cp,gas	1244.75	J/mol×K	1043.04	Joback Calculated Property
Cp,gas	1258.30	J/mol×K	1080.21	Joback Calculated Property
Cp,gas	1270.44	J/mol×K	1117.39	Joback Calculated Property
Cp,gas	1281.23	J/mol×K	1154.57	Joback Calculated Property
Cp,gas	1290.70	J/mol×K	1191.75	Joback Calculated Property

Similar Compounds

Find more compounds similar to Dimethylmalonic acid, pentafluorophenyl tetradecyl ester.

Sources

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

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