Chemical Properties of Glutaric acid, 2,2,3,3-tetrafluoropropyl 2,6-dimethylnon-1-en-3-yn-5-yl ester

InChI

InChI=1S/C19H26F4O4/c1-5-7-14(4)15(11-10-13(2)3)27-17(25)9-6-8-16(24)26-12-19(22,23)18(20)21/h14-15,18H,2,5-9,12H2,1,3-4H3

InChI Key

HRSPCHSRZDDBNL-UHFFFAOYSA-N

Formula

C19H26F4O4

SMILES

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

Molecular Weight¹

394.40

• 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	0.7770		Relay (... Calculated Property
ΔfG°	-860.37	kJ/mol	Joback Calculated Property
ΔfH°gas	-1463.02	kJ/mol	Relay (... Calculated Property
ΔfusH°	45.41	kJ/mol	Joback Calculated Property
ΔvapH°	89.18	kJ/mol	Relay (... Calculated Property
IE	9.27	eV	Relay (... Calculated Property
log10WS	-4.85		Relay (... Calculated Property
logPoct/wat	4.528		Crippen Calculated Property
McVol	287.630	ml/mol	McGowan Calculated Property
Pc	1205.63	kPa	Joback Calculated Property
Inp	[1885.00; 1885.00]
Inp	1885.00		NIST
Inp	1885.00		NIST
Tboil	576.57	K	Relay (... Calculated Property
Tc	739.24	K	Relay (... Calculated Property
Tfus	305.45	K	Relay (... Calculated Property
Vc	1.026	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[866.88; 946.21]	J/mol×K	[784.79; 970.40]
Cp,gas	866.88	J/mol×K	784.79	Joback Calculated Property
Cp,gas	882.36	J/mol×K	815.73	Joback Calculated Property
Cp,gas	896.89	J/mol×K	846.66	Joback Calculated Property
Cp,gas	910.51	J/mol×K	877.60	Joback Calculated Property
Cp,gas	923.25	J/mol×K	908.53	Joback Calculated Property
Cp,gas	935.14	J/mol×K	939.47	Joback Calculated Property
Cp,gas	946.21	J/mol×K	970.40	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3-tetrafluoropropyl 2,6-dimethylnon-1-en-3-yn-5-yl ester.

Sources

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

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