Chemical Properties of Succinic acid, nonyl 2,3,4,5-tetrafluorobenzyl ester

InChI

InChI=1S/C20H26F4O4/c1-2-3-4-5-6-7-8-11-27-16(25)9-10-17(26)28-13-14-12-15(21)19(23)20(24)18(14)22/h12H,2-11,13H2,1H3

InChI Key

IHWQKFWUXRVGNN-UHFFFAOYSA-N

Formula

C20H26F4O4

SMILES

CCCCCCCCCOC(=O)CCC(=O)OCc1cc(F)c(F)c(F)c1F

Molecular Weight¹

406.41

• 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°	-1055.67	kJ/mol	Joback Calculated Property
ΔfH°gas	-1539.52	kJ/mol	Joback Calculated Property
ΔfusH°	57.93	kJ/mol	Joback Calculated Property
ΔvapH°	80.08	kJ/mol	Joback Calculated Property
log10WS	-6.84		Crippen Calculated Property
logPoct/wat	5.360		Crippen Calculated Property
McVol	290.860	ml/mol	McGowan Calculated Property
Pc	1145.21	kPa	Joback Calculated Property
Inp	[2342.00; 2342.00]
Inp	2342.00		NIST
Inp	2342.00		NIST
Tboil	853.26	K	Joback Calculated Property
Tc	1045.55	K	Joback Calculated Property
Tfus	538.34	K	Joback Calculated Property
Vc	1.167	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[905.06; 977.67]	J/mol×K	[853.26; 1045.55]
Cp,gas	905.06	J/mol×K	853.26	Joback Calculated Property
Cp,gas	919.73	J/mol×K	885.31	Joback Calculated Property
Cp,gas	933.37	J/mol×K	917.36	Joback Calculated Property
Cp,gas	945.97	J/mol×K	949.40	Joback Calculated Property
Cp,gas	957.54	J/mol×K	981.45	Joback Calculated Property
Cp,gas	968.11	J/mol×K	1013.50	Joback Calculated Property
Cp,gas	977.67	J/mol×K	1045.55	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, nonyl 2,3,4,5-tetrafluorobenzyl ester.

Sources

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

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