Chemical Properties of Glutaric acid, 1-(4-fluorophenyl)ethyl undecyl ester

InChI

InChI=1S/C24H37FO4/c1-3-4-5-6-7-8-9-10-11-19-28-23(26)13-12-14-24(27)29-20(2)21-15-17-22(25)18-16-21/h15-18,20H,3-14,19H2,1-2H3

InChI Key

FPFONFYAWYLLCP-UHFFFAOYSA-N

Formula

C24H37FO4

SMILES

CCCCCCCCCCCOC(=O)CCCC(=O)OC(C)c1ccc(F)cc1

Molecular Weight¹

408.55

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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
ΔfG°	-411.11	kJ/mol	Joback Calculated Property
ΔfH°gas	-1004.62	kJ/mol	Joback Calculated Property
ΔfusH°	56.70	kJ/mol	Joback Calculated Property
ΔvapH°	89.06	kJ/mol	Joback Calculated Property
log10WS	-7.49		Crippen Calculated Property
logPoct/wat	6.674		Crippen Calculated Property
McVol	341.910	ml/mol	McGowan Calculated Property
Pc	1007.17	kPa	Joback Calculated Property
Inp	[2798.00; 2798.00]
Inp	2798.00		NIST
Inp	2798.00		NIST
Tboil	931.59	K	Joback Calculated Property
Tc	1140.67	K	Joback Calculated Property
Tfus	529.09	K	Joback Calculated Property
Vc	1.331	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1126.85; 1208.04]	J/mol×K	[931.59; 1140.67]
Cp,gas	1126.85	J/mol×K	931.59	Joback Calculated Property
Cp,gas	1143.68	J/mol×K	966.44	Joback Calculated Property
Cp,gas	1159.14	J/mol×K	1001.28	Joback Calculated Property
Cp,gas	1173.26	J/mol×K	1036.13	Joback Calculated Property
Cp,gas	1186.10	J/mol×K	1070.98	Joback Calculated Property
Cp,gas	1197.67	J/mol×K	1105.82	Joback Calculated Property
Cp,gas	1208.04	J/mol×K	1140.67	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 1-(4-fluorophenyl)ethyl undecyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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