Chemical Properties of Glutaric acid, 2,2,3,3-tetrafluoropropyl 2-chloro-6-fluorophenyl ester

InChI

InChI=1S/C14H12ClF5O4/c15-8-3-1-4-9(16)12(8)24-11(22)6-2-5-10(21)23-7-14(19,20)13(17)18/h1,3-4,13H,2,5-7H2

InChI Key

WBTOVAUWPFHTJU-UHFFFAOYSA-N

Formula

C14H12ClF5O4

SMILES

O=C(CCCC(=O)Oc1c(F)cccc1Cl)OCC(F)(F)C(F)F

Molecular Weight¹

374.69

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.8010		Relay (1.0) Calculated Property
ΔfG°	-1293.27	kJ/mol	Joback Calculated Property
ΔfH°gas	-1644.04	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	39.51	kJ/mol	Joback Calculated Property
ΔvapH°	88.43	kJ/mol	Relay (1.0) Calculated Property
IE	9.43	eV	Relay (1.0) Calculated Property
log10WS	-4.80		Relay (1.0) Calculated Property
logPoct/wat	3.998		Crippen Calculated Property
McVol	220.330	ml/mol	McGowan Calculated Property
Pc	1730.34	kPa	Joback Calculated Property
Inp	[1869.00; 1869.00]
Inp	1869.00		NIST
Inp	1869.00		NIST
Tboil	561.55	K	Relay (1.0) Calculated Property
Tc	775.70	K	Relay (1.0) Calculated Property
Tfus	334.37	K	Relay (1.0) Calculated Property
Vc	0.809	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[606.93; 662.81]	J/mol×K	[739.05; 927.28]
Cp,gas	606.93	J/mol×K	739.05	Joback Calculated Property
Cp,gas	618.11	J/mol×K	770.42	Joback Calculated Property
Cp,gas	628.52	J/mol×K	801.79	Joback Calculated Property
Cp,gas	638.17	J/mol×K	833.16	Joback Calculated Property
Cp,gas	647.09	J/mol×K	864.54	Joback Calculated Property
Cp,gas	655.30	J/mol×K	895.91	Joback Calculated Property
Cp,gas	662.81	J/mol×K	927.28	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3-tetrafluoropropyl 2-chloro-6-fluorophenyl ester.

Sources

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

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