Chemical Properties of Glutaric acid, dodec-2-en-1-yl 2-fluoro-3-trifluoromethylphenyl ester

InChI

InChI=1S/C24H32F4O4/c1-2-3-4-5-6-7-8-9-10-11-18-31-21(29)16-13-17-22(30)32-20-15-12-14-19(23(20)25)24(26,27)28/h10-12,14-15H,2-9,13,16-18H2,1H3/b11-10+

InChI Key

OQUIGVPURKNMDF-ZHACJKMWSA-N

Formula

C24H32F4O4

SMILES

CCCCCCCCCC=CCOC(=O)CCCC(=O)Oc1cccc(C(F)(F)F)c1F

Molecular Weight¹

460.50

• 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°	-919.67	kJ/mol	Joback Calculated Property
ΔfH°gas	-1490.67	kJ/mol	Joback Calculated Property
ΔfusH°	61.86	kJ/mol	Joback Calculated Property
ΔvapH°	86.32	kJ/mol	Joback Calculated Property
log10WS	-8.22		Crippen Calculated Property
logPoct/wat	7.160		Crippen Calculated Property
McVol	342.920	ml/mol	McGowan Calculated Property
Pc	953.78	kPa	Joback Calculated Property
Inp	[2684.00; 2684.00]
Inp	2684.00		NIST
Inp	2684.00		NIST
Tboil	935.75	K	Joback Calculated Property
Tc	1145.84	K	Joback Calculated Property
Tfus	555.72	K	Joback Calculated Property
Vc	1.361	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1119.01; 1197.81]	J/mol×K	[935.75; 1145.84]
Cp,gas	1119.01	J/mol×K	935.75	Joback Calculated Property
Cp,gas	1134.81	J/mol×K	970.76	Joback Calculated Property
Cp,gas	1149.45	J/mol×K	1005.78	Joback Calculated Property
Cp,gas	1163.00	J/mol×K	1040.79	Joback Calculated Property
Cp,gas	1175.54	J/mol×K	1075.81	Joback Calculated Property
Cp,gas	1187.12	J/mol×K	1110.82	Joback Calculated Property
Cp,gas	1197.81	J/mol×K	1145.84	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, dodec-2-en-1-yl 2-fluoro-3-trifluoromethylphenyl ester.

Sources

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

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