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

InChI

InChI=1S/C19H20F8O4/c20-16(21)18(24,25)19(26,27)17(22,23)12-31-15(29)10-4-9-14(28)30-11-5-8-13-6-2-1-3-7-13/h1-3,6-7,16H,4-5,8-12H2

InChI Key

IFMWXBONHNLAKS-UHFFFAOYSA-N

Formula

C19H20F8O4

SMILES

O=C(CCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)OCCCc1ccccc1

Molecular Weight¹

464.35

• 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°	-1798.73	kJ/mol	Joback Calculated Property
ΔfH°gas	-2288.97	kJ/mol	Joback Calculated Property
ΔfusH°	43.46	kJ/mol	Joback Calculated Property
ΔvapH°	67.66	kJ/mol	Joback Calculated Property
log10WS	-5.86		Crippen Calculated Property
logPoct/wat	5.047		Crippen Calculated Property
McVol	283.850	ml/mol	McGowan Calculated Property
Pc	1177.66	kPa	Joback Calculated Property
Inp	[2127.00; 2127.00]
Inp	2127.00		NIST
Inp	2127.00		NIST
Tboil	797.41	K	Joback Calculated Property
Tc	980.58	K	Joback Calculated Property
Tfus	471.61	K	Joback Calculated Property
Vc	1.145	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[884.78; 952.01]	J/mol×K	[797.41; 980.58]
Cp,gas	884.78	J/mol×K	797.41	Joback Calculated Property
Cp,gas	898.13	J/mol×K	827.94	Joback Calculated Property
Cp,gas	910.54	J/mol×K	858.47	Joback Calculated Property
Cp,gas	922.06	J/mol×K	888.99	Joback Calculated Property
Cp,gas	932.77	J/mol×K	919.52	Joback Calculated Property
Cp,gas	942.73	J/mol×K	950.05	Joback Calculated Property
Cp,gas	952.01	J/mol×K	980.58	Joback Calculated Property

Similar Compounds

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

Sources

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

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