Chemical Properties of Succinic acid, di(1-(pentafluorophenyl)ethyl) ester

InChI

InChI=1S/C20H12F10O4/c1-5(9-11(21)15(25)19(29)16(26)12(9)22)33-7(31)3-4-8(32)34-6(2)10-13(23)17(27)20(30)18(28)14(10)24/h5-6H,3-4H2,1-2H3

InChI Key

DDVHAYJWVFOKEN-UHFFFAOYSA-N

Formula

C20H12F10O4

SMILES

CC(OC(=O)CCC(=O)OC(C)c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F

Molecular Weight¹

506.29

• 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°	-2174.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-2559.03	kJ/mol	Joback Calculated Property
ΔfusH°	61.08	kJ/mol	Joback Calculated Property
ΔvapH°	80.65	kJ/mol	Joback Calculated Property
log10WS	-8.36		Crippen Calculated Property
logPoct/wat	5.766		Crippen Calculated Property
McVol	277.720	ml/mol	McGowan Calculated Property
Pc	1135.20	kPa	Joback Calculated Property
Inp	[2080.00; 2080.00]
Inp	2080.00		NIST
Inp	2080.00		NIST
Tboil	904.56	K	Joback Calculated Property
Tc	1107.53	K	Joback Calculated Property
Tfus	613.42	K	Joback Calculated Property
Vc	1.155	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[843.83; 889.68]	J/mol×K	[904.56; 1107.53]
Cp,gas	843.83	J/mol×K	904.56	Joback Calculated Property
Cp,gas	854.31	J/mol×K	938.39	Joback Calculated Property
Cp,gas	863.67	J/mol×K	972.22	Joback Calculated Property
Cp,gas	871.90	J/mol×K	1006.05	Joback Calculated Property
Cp,gas	878.98	J/mol×K	1039.88	Joback Calculated Property
Cp,gas	884.91	J/mol×K	1073.70	Joback Calculated Property
Cp,gas	889.68	J/mol×K	1107.53	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, di(1-(pentafluorophenyl)ethyl) ester.

Sources

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

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