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

InChI

InChI=1S/C19H20F8O4/c1-11(2)12-6-3-4-7-13(12)31-15(29)9-5-8-14(28)30-10-17(22,23)19(26,27)18(24,25)16(20)21/h3-4,6-7,11,16H,5,8-10H2,1-2H3

InChI Key

JFYNBDZXDALEQN-UHFFFAOYSA-N

Formula

C19H20F8O4

SMILES

CC(C)c1ccccc1OC(=O)CCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F

Molecular Weight¹

464.35

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.9004		Relay (... Calculated Property
ΔfG°	-1810.80	kJ/mol	Joback Calculated Property
ΔfH°gas	-2393.94	kJ/mol	Relay (... Calculated Property
ΔfusH°	39.54	kJ/mol	Joback Calculated Property
ΔvapH°	94.53	kJ/mol	Relay (... Calculated Property
IE	8.82	eV	Relay (... Calculated Property
log10WS	-6.27		Relay (... Calculated Property
logPoct/wat	5.600		Crippen Calculated Property
McVol	283.850	ml/mol	McGowan Calculated Property
Pc	1172.03	kPa	Joback Calculated Property
Inp	[1993.00; 1993.00]
Inp	1993.00		NIST
Inp	1993.00		NIST
Tboil	610.50	K	Relay (... Calculated Property
Tc	784.67	K	Relay (... Calculated Property
Tfus	328.15	K	Relay (... Calculated Property
Vc	1.051	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[884.45; 951.42]	J/mol×K	[801.95; 987.08]
Cp,gas	884.45	J/mol×K	801.95	Joback Calculated Property
Cp,gas	897.79	J/mol×K	832.80	Joback Calculated Property
Cp,gas	910.17	J/mol×K	863.66	Joback Calculated Property
Cp,gas	921.67	J/mol×K	894.51	Joback Calculated Property
Cp,gas	932.33	J/mol×K	925.37	Joback Calculated Property
Cp,gas	942.23	J/mol×K	956.22	Joback Calculated Property
Cp,gas	951.42	J/mol×K	987.08	Joback Calculated Property

Similar Compounds

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

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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