Chemical Properties of Glutaric acid, 2,4,6-trichlorophenyl 2,2,3,3,3-pentafluoropropyl ester

InChI

InChI=1S/C14H10Cl3F5O4/c15-7-4-8(16)12(9(17)5-7)26-11(24)3-1-2-10(23)25-6-13(18,19)14(20,21)22/h4-5H,1-3,6H2

InChI Key

QANVWSTXKUHZCG-UHFFFAOYSA-N

Formula

C14H10Cl3F5O4

SMILES

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

Molecular Weight¹

443.58

• 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°	-1321.48	kJ/mol	Joback Calculated Property
ΔfH°gas	-1665.04	kJ/mol	Joback Calculated Property
ΔfusH°	43.63	kJ/mol	Joback Calculated Property
ΔvapH°	75.81	kJ/mol	Joback Calculated Property
log10WS	-6.19		Crippen Calculated Property
logPoct/wat	5.463		Crippen Calculated Property
McVol	244.810	ml/mol	McGowan Calculated Property
Pc	1623.29	kPa	Joback Calculated Property
Inp	[1986.00; 1986.00]
Inp	1986.00		NIST
Inp	1986.00		NIST
Tboil	816.10	K	Joback Calculated Property
Tc	1018.08	K	Joback Calculated Property
Tfus	553.39	K	Joback Calculated Property
Vc	0.975	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[651.48; 695.02]	J/mol×K	[816.10; 1018.08]
Cp,gas	651.48	J/mol×K	816.10	Joback Calculated Property
Cp,gas	660.55	J/mol×K	849.76	Joback Calculated Property
Cp,gas	668.84	J/mol×K	883.43	Joback Calculated Property
Cp,gas	676.39	J/mol×K	917.09	Joback Calculated Property
Cp,gas	683.24	J/mol×K	950.76	Joback Calculated Property
Cp,gas	689.44	J/mol×K	984.42	Joback Calculated Property
Cp,gas	695.02	J/mol×K	1018.08	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,4,6-trichlorophenyl 2,2,3,3,3-pentafluoropropyl ester.

Sources

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

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