Chemical Properties of Glutaric acid, 2,2,3,3-tetrafluoropropyl 2-methylpent-3-yl ester

InChI

InChI=1S/C14H22F4O4/c1-4-10(9(2)3)22-12(20)7-5-6-11(19)21-8-14(17,18)13(15)16/h9-10,13H,4-8H2,1-3H3

InChI Key

BNSYQLBVEJSAMG-UHFFFAOYSA-N

Formula

C14H22F4O4

SMILES

CCC(OC(=O)CCCC(=O)OCC(F)(F)C(F)F)C(C)C

Molecular Weight¹

330.32

• 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°	-1184.56	kJ/mol	Joback Calculated Property
ΔfH°gas	-1630.92	kJ/mol	Joback Calculated Property
ΔfusH°	31.93	kJ/mol	Joback Calculated Property
ΔvapH°	59.34	kJ/mol	Joback Calculated Property
log10WS	-3.91		Crippen Calculated Property
logPoct/wat	3.578		Crippen Calculated Property
McVol	230.080	ml/mol	McGowan Calculated Property
Pc	1471.36	kPa	Joback Calculated Property
Inp	[1532.00; 1532.00]
Inp	1532.00		NIST
Inp	1532.00		NIST
Tboil	664.83	K	Joback Calculated Property
Tc	832.74	K	Joback Calculated Property
Tfus	351.64	K	Joback Calculated Property
Vc	0.910	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[657.82; 734.96]	J/mol×K	[664.83; 832.74]
Cp,gas	657.82	J/mol×K	664.83	Joback Calculated Property
Cp,gas	672.49	J/mol×K	692.81	Joback Calculated Property
Cp,gas	686.40	J/mol×K	720.80	Joback Calculated Property
Cp,gas	699.60	J/mol×K	748.78	Joback Calculated Property
Cp,gas	712.07	J/mol×K	776.77	Joback Calculated Property
Cp,gas	723.86	J/mol×K	804.75	Joback Calculated Property
Cp,gas	734.96	J/mol×K	832.74	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3-tetrafluoropropyl 2-methylpent-3-yl ester.

Sources

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

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