Chemical Properties of Glutaric acid, pentyl 2,3,4,5-tetrafluorobenzyl ester

InChI

InChI=1S/C17H20F4O4/c1-2-3-4-8-24-13(22)6-5-7-14(23)25-10-11-9-12(18)16(20)17(21)15(11)19/h9H,2-8,10H2,1H3

InChI Key

JFXFGZOXJRUOJK-UHFFFAOYSA-N

Formula

C17H20F4O4

SMILES

CCCCCOC(=O)CCCC(=O)OCc1cc(F)c(F)c(F)c1F

Molecular Weight¹

364.33

• 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	0.9132		Relay (1.0) Calculated Property
ΔfG°	-1080.93	kJ/mol	Joback Calculated Property
ΔfH°gas	-1440.72	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	50.16	kJ/mol	Joback Calculated Property
ΔvapH°	88.50	kJ/mol	Relay (1.0) Calculated Property
IE	9.05	eV	Relay (1.0) Calculated Property
log10WS	-5.64		Relay (1.0) Calculated Property
logPoct/wat	4.190		Crippen Calculated Property
McVol	248.590	ml/mol	McGowan Calculated Property
Pc	1405.90	kPa	Joback Calculated Property
Inp	[2134.00; 2134.00]
Inp	2134.00		NIST
Inp	2134.00		NIST
Tboil	592.88	K	Relay (1.0) Calculated Property
Tc	763.09	K	Relay (1.0) Calculated Property
Tfus	279.40	K	Relay (1.0) Calculated Property
Vc	0.935	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[732.41; 800.45]	J/mol×K	[784.62; 968.87]
Cp,gas	732.41	J/mol×K	784.62	Joback Calculated Property
Cp,gas	745.82	J/mol×K	815.33	Joback Calculated Property
Cp,gas	758.41	J/mol×K	846.04	Joback Calculated Property
Cp,gas	770.16	J/mol×K	876.74	Joback Calculated Property
Cp,gas	781.08	J/mol×K	907.45	Joback Calculated Property
Cp,gas	791.18	J/mol×K	938.16	Joback Calculated Property
Cp,gas	800.45	J/mol×K	968.87	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, pentyl 2,3,4,5-tetrafluorobenzyl ester.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.