Chemical Properties of Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 4-chloro-2-methoxyphenyl ester

InChI

InChI=1S/C17H15ClF8O5/c1-29-11-7-9(18)5-6-10(11)31-13(28)4-2-3-12(27)30-8-15(21,22)17(25,26)16(23,24)14(19)20/h5-7,14H,2-4,8H2,1H3

InChI Key

BIPFNQRGCGDMAC-UHFFFAOYSA-N

Formula

C17H15ClF8O5

SMILES

COc1cc(Cl)ccc1OC(=O)CCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F

Molecular Weight¹

486.74

• 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°	-1951.76	kJ/mol	Joback Calculated Property
ΔfH°gas	-2418.59	kJ/mol	Joback Calculated Property
ΔfusH°	42.88	kJ/mol	Joback Calculated Property
ΔvapH°	71.33	kJ/mol	Joback Calculated Property
log10WS	-6.06		Crippen Calculated Property
logPoct/wat	5.138		Crippen Calculated Property
McVol	273.780	ml/mol	McGowan Calculated Property
Pc	1270.06	kPa	Joback Calculated Property
Inp	[2184.00; 2184.00]
Inp	2184.00		NIST
Inp	2184.00		NIST
Tboil	821.46	K	Joback Calculated Property
Tc	1010.62	K	Joback Calculated Property
Tfus	526.26	K	Joback Calculated Property
Vc	1.099	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[822.89; 877.43]	J/mol×K	[821.46; 1010.62]
Cp,gas	822.89	J/mol×K	821.46	Joback Calculated Property
Cp,gas	834.05	J/mol×K	852.99	Joback Calculated Property
Cp,gas	844.32	J/mol×K	884.51	Joback Calculated Property
Cp,gas	853.75	J/mol×K	916.04	Joback Calculated Property
Cp,gas	862.38	J/mol×K	947.57	Joback Calculated Property
Cp,gas	870.25	J/mol×K	979.10	Joback Calculated Property
Cp,gas	877.43	J/mol×K	1010.62	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 4-chloro-2-methoxyphenyl ester.

Sources

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

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