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

InChI

InChI=1S/C12H14F8O4/c1-2-23-7(21)4-3-5-8(22)24-6-10(15,16)12(19,20)11(17,18)9(13)14/h9H,2-6H2,1H3

InChI Key

XIGICNZSYKZAPH-UHFFFAOYSA-N

Formula

C12H14F8O4

SMILES

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

Molecular Weight¹

374.22

• 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	0.7497		Relay (... Calculated Property
ΔfG°	-1970.08	kJ/mol	Joback Calculated Property
ΔfH°gas	-2474.78	kJ/mol	Relay (... Calculated Property
ΔfusH°	31.29	kJ/mol	Joback Calculated Property
ΔvapH°	76.41	kJ/mol	Relay (... Calculated Property
IE	10.19	eV	Relay (... Calculated Property
log10WS	-4.36		Relay (... Calculated Property
logPoct/wat	3.434		Crippen Calculated Property
McVol	208.980	ml/mol	McGowan Calculated Property
Pc	1510.50	kPa	Joback Calculated Property
Inp	[1434.00; 1434.00]
Inp	1434.00		NIST
Inp	1434.00		NIST
Tboil	517.60	K	Relay (... Calculated Property
Tc	653.90	K	Relay (... Calculated Property
Tfus	281.06	K	Relay (... Calculated Property
Vc	0.801	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[590.05; 654.04]	J/mol×K	[610.57; 765.62]
Cp,gas	590.05	J/mol×K	610.57	Joback Calculated Property
Cp,gas	602.35	J/mol×K	636.41	Joback Calculated Property
Cp,gas	613.95	J/mol×K	662.25	Joback Calculated Property
Cp,gas	624.90	J/mol×K	688.09	Joback Calculated Property
Cp,gas	635.21	J/mol×K	713.94	Joback Calculated Property
Cp,gas	644.92	J/mol×K	739.78	Joback Calculated Property
Cp,gas	654.04	J/mol×K	765.62	Joback Calculated Property

Similar Compounds

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

Sources

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

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