Chemical Properties of Glutaric acid, di(3,5-difluorophenyl) ester

InChI

InChI=1S/C17H12F4O4/c18-10-4-11(19)7-14(6-10)24-16(22)2-1-3-17(23)25-15-8-12(20)5-13(21)9-15/h4-9H,1-3H2

InChI Key

FQLRVTBKUWPDHF-UHFFFAOYSA-N

Formula

C17H12F4O4

SMILES

O=C(CCCC(=O)Oc1cc(F)cc(F)c1)Oc1cc(F)cc(F)c1

Molecular Weight¹

356.27

• 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°	-968.52	kJ/mol	Joback Calculated Property
ΔfH°gas	-1241.07	kJ/mol	Joback Calculated Property
ΔfusH°	44.21	kJ/mol	Joback Calculated Property
ΔvapH°	75.68	kJ/mol	Joback Calculated Property
log10WS	-5.49		Crippen Calculated Property
logPoct/wat	3.924		Crippen Calculated Property
McVol	224.830	ml/mol	McGowan Calculated Property
Pc	1832.54	kPa	Joback Calculated Property
Inp	[2176.00; 2176.00]
Inp	2176.00		NIST
Inp	2176.00		NIST
Tboil	811.30	K	Joback Calculated Property
Tc	1016.55	K	Joback Calculated Property
Tfus	530.95	K	Joback Calculated Property
Vc	0.891	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[639.26; 693.63]	J/mol×K	[811.30; 1016.55]
Cp,gas	639.26	J/mol×K	811.30	Joback Calculated Property
Cp,gas	650.67	J/mol×K	845.51	Joback Calculated Property
Cp,gas	661.13	J/mol×K	879.72	Joback Calculated Property
Cp,gas	670.65	J/mol×K	913.92	Joback Calculated Property
Cp,gas	679.23	J/mol×K	948.13	Joback Calculated Property
Cp,gas	686.89	J/mol×K	982.34	Joback Calculated Property
Cp,gas	693.63	J/mol×K	1016.55	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, di(3,5-difluorophenyl) ester.

Sources

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

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