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

InChI

InChI=1S/C15H11F9O4/c16-9-6(10(17)12(19)13(20)11(9)18)4-27-7(25)2-1-3-8(26)28-5-15(23,24)14(21)22/h14H,1-5H2

InChI Key

RDLRXAYEINDPIQ-UHFFFAOYSA-N

Formula

C15H11F9O4

SMILES

O=C(CCCC(=O)OCC(F)(F)C(F)F)OCc1c(F)c(F)c(F)c(F)c1F

Molecular Weight¹

426.23

• 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°	-2081.05	kJ/mol	Joback Calculated Property
ΔfH°gas	-2442.37	kJ/mol	Joback Calculated Property
ΔfusH°	49.06	kJ/mol	Joback Calculated Property
ΔvapH°	63.84	kJ/mol	Joback Calculated Property
log10WS	-5.71		Crippen Calculated Property
logPoct/wat	4.039		Crippen Calculated Property
McVol	229.260	ml/mol	McGowan Calculated Property
Pc	1384.02	kPa	Joback Calculated Property
Inp	[1708.00; 1708.00]
Inp	1708.00		NIST
Inp	1708.00		NIST
Tboil	736.52	K	Joback Calculated Property
Tc	907.09	K	Joback Calculated Property
Tfus	484.88	K	Joback Calculated Property
Vc	0.961	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[663.04; 719.08]	J/mol×K	[736.52; 907.09]
Cp,gas	663.04	J/mol×K	736.52	Joback Calculated Property
Cp,gas	674.00	J/mol×K	764.95	Joback Calculated Property
Cp,gas	684.30	J/mol×K	793.38	Joback Calculated Property
Cp,gas	693.95	J/mol×K	821.80	Joback Calculated Property
Cp,gas	702.96	J/mol×K	850.23	Joback Calculated Property
Cp,gas	711.33	J/mol×K	878.66	Joback Calculated Property
Cp,gas	719.08	J/mol×K	907.09	Joback Calculated Property

Similar Compounds

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

Sources

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

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