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

InChI

InChI=1S/C18H16F8O5/c1-10(27)11-5-7-12(8-6-11)31-14(29)4-2-3-13(28)30-9-16(21,22)18(25,26)17(23,24)15(19)20/h5-8,15H,2-4,9H2,1H3

InChI Key

OSPWJLINCCDNPD-UHFFFAOYSA-N

Formula

C18H16F8O5

SMILES

CC(=O)c1ccc(OC(=O)CCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)cc1

Molecular Weight¹

464.30

• 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°	-1945.70	kJ/mol	Joback Calculated Property
ΔfH°gas	-2392.38	kJ/mol	Joback Calculated Property
ΔfusH°	42.08	kJ/mol	Joback Calculated Property
ΔvapH°	72.85	kJ/mol	Joback Calculated Property
log10WS	-5.91		Crippen Calculated Property
logPoct/wat	4.679		Crippen Calculated Property
McVol	271.330	ml/mol	McGowan Calculated Property
Pc	1303.29	kPa	Joback Calculated Property
Inp	[2257.00; 2257.00]
Inp	2257.00		NIST
Inp	2257.00		NIST
Tboil	833.38	K	Joback Calculated Property
Tc	1024.58	K	Joback Calculated Property
Tfus	522.79	K	Joback Calculated Property
Vc	1.095	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[841.70; 897.70]	J/mol×K	[833.38; 1024.58]
Cp,gas	841.70	J/mol×K	833.38	Joback Calculated Property
Cp,gas	853.07	J/mol×K	865.25	Joback Calculated Property
Cp,gas	863.54	J/mol×K	897.11	Joback Calculated Property
Cp,gas	873.18	J/mol×K	928.98	Joback Calculated Property
Cp,gas	882.04	J/mol×K	960.85	Joback Calculated Property
Cp,gas	890.19	J/mol×K	992.72	Joback Calculated Property
Cp,gas	897.70	J/mol×K	1024.58	Joback Calculated Property

Similar Compounds

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

Sources

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

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