Chemical Properties of Glutaric acid, 2,2,3,3-tetrafluoropropyl 4-chlorobenzyl ester

InChI

InChI=1S/C15H15ClF4O4/c16-11-6-4-10(5-7-11)8-23-12(21)2-1-3-13(22)24-9-15(19,20)14(17)18/h4-7,14H,1-3,8-9H2

InChI Key

OZKAQPKNVSYKCB-UHFFFAOYSA-N

Formula

C15H15ClF4O4

SMILES

O=C(CCCC(=O)OCC(F)(F)C(F)F)OCc1ccc(Cl)cc1

Molecular Weight¹

370.72

• 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°	-1080.41	kJ/mol	Joback Calculated Property
ΔfH°gas	-1431.68	kJ/mol	Joback Calculated Property
ΔfusH°	39.41	kJ/mol	Joback Calculated Property
ΔvapH°	69.67	kJ/mol	Joback Calculated Property
log10WS	-4.74		Crippen Calculated Property
logPoct/wat	3.997		Crippen Calculated Property
McVol	232.650	ml/mol	McGowan Calculated Property
Pc	1679.66	kPa	Joback Calculated Property
Inp	[2043.00; 2043.00]
Inp	2043.00		NIST
Inp	2043.00		NIST
Tboil	757.68	K	Joback Calculated Property
Tc	950.09	K	Joback Calculated Property
Tfus	461.77	K	Joback Calculated Property
Vc	0.919	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[653.76; 714.06]	J/mol×K	[757.68; 950.09]
Cp,gas	653.76	J/mol×K	757.68	Joback Calculated Property
Cp,gas	665.87	J/mol×K	789.75	Joback Calculated Property
Cp,gas	677.12	J/mol×K	821.82	Joback Calculated Property
Cp,gas	687.53	J/mol×K	853.88	Joback Calculated Property
Cp,gas	697.14	J/mol×K	885.95	Joback Calculated Property
Cp,gas	705.98	J/mol×K	918.02	Joback Calculated Property
Cp,gas	714.06	J/mol×K	950.09	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3-tetrafluoropropyl 4-chlorobenzyl ester.

Sources

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

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