Chemical Properties of Glutaric acid, butyl 2,2,3,3,4,4,4-heptafluorobutyl ester

InChI

InChI=1S/C13H17F7O4/c1-2-3-7-23-9(21)5-4-6-10(22)24-8-11(14,15)12(16,17)13(18,19)20/h2-8H2,1H3

InChI Key

QSOOQBSMLHTGJM-UHFFFAOYSA-N

Formula

C13H17F7O4

SMILES

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

Molecular Weight¹

370.26

• 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	0.7910		Relay (... Calculated Property
ΔfG°	-1764.41	kJ/mol	Joback Calculated Property
ΔfH°gas	-2350.92	kJ/mol	Relay (... Calculated Property
ΔfusH°	34.32	kJ/mol	Joback Calculated Property
ΔvapH°	70.28	kJ/mol	Relay (... Calculated Property
IE	10.34	eV	Relay (... Calculated Property
log10WS	-4.54		Relay (... Calculated Property
logPoct/wat	3.876		Crippen Calculated Property
McVol	221.300	ml/mol	McGowan Calculated Property
Pc	1443.54	kPa	Joback Calculated Property
Inp	[1539.00; 1539.00]
Inp	1539.00		NIST
Inp	1539.00		NIST
Tboil	511.27	K	Relay (... Calculated Property
Tc	619.54	K	Relay (... Calculated Property
Tfus	235.27	K	Relay (... Calculated Property
Vc	0.840	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[632.98; 700.61]	J/mol×K	[634.62; 793.03]
Cp,gas	632.98	J/mol×K	634.62	Joback Calculated Property
Cp,gas	645.95	J/mol×K	661.02	Joback Calculated Property
Cp,gas	658.21	J/mol×K	687.42	Joback Calculated Property
Cp,gas	669.77	J/mol×K	713.83	Joback Calculated Property
Cp,gas	680.67	J/mol×K	740.23	Joback Calculated Property
Cp,gas	690.94	J/mol×K	766.63	Joback Calculated Property
Cp,gas	700.61	J/mol×K	793.03	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, butyl 2,2,3,3,4,4,4-heptafluorobutyl ester.

Sources

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

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