Chemical Properties of Glutaric acid, 2,2,3,3-tetrafluoropropyl 8-chlorooctyl ester

InChI

InChI=1S/C16H25ClF4O4/c17-10-5-3-1-2-4-6-11-24-13(22)8-7-9-14(23)25-12-16(20,21)15(18)19/h15H,1-12H2

InChI Key

SPMOJZIGRAGHQA-UHFFFAOYSA-N

Formula

C16H25ClF4O4

SMILES

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

Molecular Weight¹

392.81

• 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	0.9614		Relay (1.0) Calculated Property
ΔfG°	-1174.77	kJ/mol	Joback Calculated Property
ΔfH°gas	-1769.26	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	48.35	kJ/mol	Joback Calculated Property
ΔvapH°	95.00	kJ/mol	Relay (1.0) Calculated Property
IE	10.33	eV	Relay (1.0) Calculated Property
log10WS	-5.14		Relay (1.0) Calculated Property
logPoct/wat	4.723		Crippen Calculated Property
McVol	270.500	ml/mol	McGowan Calculated Property
Pc	1229.42	kPa	Joback Calculated Property
Inp	[2137.00; 2137.00]
Inp	2137.00		NIST
Inp	2137.00		NIST
Tboil	589.49	K	Relay (1.0) Calculated Property
Tc	755.00	K	Relay (1.0) Calculated Property
Tfus	310.14	K	Relay (1.0) Calculated Property
Vc	1.013	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[797.91; 873.09]	J/mol×K	[748.90; 922.10]
Cp,gas	797.91	J/mol×K	748.90	Joback Calculated Property
Cp,gas	812.40	J/mol×K	777.77	Joback Calculated Property
Cp,gas	826.08	J/mol×K	806.63	Joback Calculated Property
Cp,gas	838.96	J/mol×K	835.50	Joback Calculated Property
Cp,gas	851.08	J/mol×K	864.37	Joback Calculated Property
Cp,gas	862.45	J/mol×K	893.23	Joback Calculated Property
Cp,gas	873.09	J/mol×K	922.10	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3-tetrafluoropropyl 8-chlorooctyl ester.

Sources

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

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