Chemical Properties of Glutaric acid, 2,2,3,3-tetrafluoropropyl 2,3-dichlorophenyl ester

InChI

InChI=1S/C14H12Cl2F4O4/c15-8-3-1-4-9(12(8)16)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

LPGPJVRTHUGYLS-UHFFFAOYSA-N

Formula

C14H12Cl2F4O4

SMILES

O=C(CCCC(=O)Oc1cccc(Cl)c1Cl)OCC(F)(F)C(F)F

Molecular Weight¹

391.14

• 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	0.8204		Relay (1.0) Calculated Property
ΔfG°	-1110.39	kJ/mol	Joback Calculated Property
ΔfH°gas	-1522.21	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	40.63	kJ/mol	Joback Calculated Property
ΔvapH°	93.08	kJ/mol	Relay (1.0) Calculated Property
IE	9.27	eV	Relay (1.0) Calculated Property
log10WS	-5.26		Relay (1.0) Calculated Property
logPoct/wat	4.513		Crippen Calculated Property
McVol	230.800	ml/mol	McGowan Calculated Property
Pc	1741.91	kPa	Joback Calculated Property
Inp	[2092.00; 2092.00]
Inp	2092.00		NIST
Inp	2092.00		NIST
Tboil	599.17	K	Relay (1.0) Calculated Property
Tc	810.77	K	Relay (1.0) Calculated Property
Tfus	336.06	K	Relay (1.0) Calculated Property
Vc	0.838	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[622.52; 674.29]	J/mol×K	[777.21; 975.36]
Cp,gas	622.52	J/mol×K	777.21	Joback Calculated Property
Cp,gas	633.12	J/mol×K	810.24	Joback Calculated Property
Cp,gas	642.90	J/mol×K	843.26	Joback Calculated Property
Cp,gas	651.88	J/mol×K	876.29	Joback Calculated Property
Cp,gas	660.09	J/mol×K	909.31	Joback Calculated Property
Cp,gas	667.55	J/mol×K	942.34	Joback Calculated Property
Cp,gas	674.29	J/mol×K	975.36	Joback Calculated Property

Similar Compounds

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

Sources

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

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