Chemical Properties of Glutaric acid, hexa-1,5-dien-3-yl 2,2,3,3-tetrafluoropropyl ester

InChI

InChI=1S/C14H18F4O4/c1-3-6-10(4-2)22-12(20)8-5-7-11(19)21-9-14(17,18)13(15)16/h3-4,10,13H,1-2,5-9H2

InChI Key

CPNPQORXFCLHGW-UHFFFAOYSA-N

Formula

C14H18F4O4

SMILES

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

Molecular Weight¹

326.28

• 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	0.7020		Relay (1.0) Calculated Property
ΔfG°	-1006.44	kJ/mol	Joback Calculated Property
ΔfH°gas	-1554.20	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	32.89	kJ/mol	Joback Calculated Property
ΔvapH°	77.12	kJ/mol	Relay (1.0) Calculated Property
IE	9.96	eV	Relay (1.0) Calculated Property
log10WS	-3.25		Relay (1.0) Calculated Property
logPoct/wat	3.274		Crippen Calculated Property
McVol	221.480	ml/mol	McGowan Calculated Property
Pc	1561.05	kPa	Joback Calculated Property
Inp	[1524.00; 1524.00]
Inp	1524.00		NIST
Inp	1524.00		NIST
Tboil	538.01	K	Relay (1.0) Calculated Property
Tc	685.37	K	Relay (1.0) Calculated Property
Tfus	269.62	K	Relay (1.0) Calculated Property
Vc	0.777	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[611.51; 681.60]	J/mol×K	[658.63; 827.99]
Cp,gas	611.51	J/mol×K	658.63	Joback Calculated Property
Cp,gas	624.90	J/mol×K	686.86	Joback Calculated Property
Cp,gas	637.58	J/mol×K	715.08	Joback Calculated Property
Cp,gas	649.57	J/mol×K	743.31	Joback Calculated Property
Cp,gas	660.89	J/mol×K	771.53	Joback Calculated Property
Cp,gas	671.56	J/mol×K	799.76	Joback Calculated Property
Cp,gas	681.60	J/mol×K	827.99	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, hexa-1,5-dien-3-yl 2,2,3,3-tetrafluoropropyl ester.

Sources

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

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