Chemical Properties of Glutaric acid, 2,4,6-trichlorophenyl 2-chloro-6-fluorophenyl ester

InChI

InChI=1S/C17H11Cl4FO4/c18-9-7-11(20)16(12(21)8-9)25-14(23)5-2-6-15(24)26-17-10(19)3-1-4-13(17)22/h1,3-4,7-8H,2,5-6H2

InChI Key

SREXNFXJQVWXAV-UHFFFAOYSA-N

Formula

C17H11Cl4FO4

SMILES

O=C(CCCC(=O)Oc1c(Cl)cc(Cl)cc1Cl)Oc1c(F)cccc1Cl

Molecular Weight¹

440.08

• 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°	-441.44	kJ/mol	Joback Calculated Property
ΔfH°gas	-727.17	kJ/mol	Joback Calculated Property
ΔfusH°	51.37	kJ/mol	Joback Calculated Property
ΔvapH°	96.33	kJ/mol	Joback Calculated Property
log10WS	-7.24		Crippen Calculated Property
logPoct/wat	6.121		Crippen Calculated Property
McVol	268.480	ml/mol	McGowan Calculated Property
Pc	1789.39	kPa	Joback Calculated Property
Inp	[2898.00; 2898.00]
Inp	2898.00		NIST
Inp	2898.00		NIST
Tboil	968.19	K	Joback Calculated Property
Tc	1207.34	K	Joback Calculated Property
Tfus	661.38	K	Joback Calculated Property
Vc	1.034	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[693.18; 721.13]	J/mol×K	[968.19; 1207.34]
Cp,gas	693.18	J/mol×K	968.19	Joback Calculated Property
Cp,gas	700.75	J/mol×K	1008.05	Joback Calculated Property
Cp,gas	707.14	J/mol×K	1047.91	Joback Calculated Property
Cp,gas	712.36	J/mol×K	1087.76	Joback Calculated Property
Cp,gas	716.42	J/mol×K	1127.62	Joback Calculated Property
Cp,gas	719.34	J/mol×K	1167.48	Joback Calculated Property
Cp,gas	721.13	J/mol×K	1207.34	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,4,6-trichlorophenyl 2-chloro-6-fluorophenyl ester.

Sources

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

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