Chemical Properties of Succinic acid, di(1-(2,6-difluorophenyl)ethyl) ester

InChI

InChI=1S/C20H18F4O4/c1-11(19-13(21)5-3-6-14(19)22)27-17(25)9-10-18(26)28-12(2)20-15(23)7-4-8-16(20)24/h3-8,11-12H,9-10H2,1-2H3

InChI Key

LDWLFUWBXSCGHV-UHFFFAOYSA-N

Formula

C20H18F4O4

SMILES

CC(OC(=O)CCC(=O)OC(C)c1c(F)cccc1F)c1c(F)cccc1F

Molecular Weight¹

398.35

• 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°	-948.14	kJ/mol	Joback Calculated Property
ΔfH°gas	-1313.55	kJ/mol	Joback Calculated Property
ΔfusH°	44.93	kJ/mol	Joback Calculated Property
ΔvapH°	81.58	kJ/mol	Joback Calculated Property
log10WS	-6.37		Crippen Calculated Property
logPoct/wat	4.932		Crippen Calculated Property
McVol	267.100	ml/mol	McGowan Calculated Property
Pc	1470.23	kPa	Joback Calculated Property
Inp	[2317.00; 2317.00]
Inp	2317.00		NIST
Inp	2317.00		NIST
Tboil	879.06	K	Joback Calculated Property
Tc	1088.16	K	Joback Calculated Property
Tfus	534.76	K	Joback Calculated Property
Vc	1.048	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[808.30; 865.62]	J/mol×K	[879.06; 1088.16]
Cp,gas	808.30	J/mol×K	879.06	Joback Calculated Property
Cp,gas	820.67	J/mol×K	913.91	Joback Calculated Property
Cp,gas	831.89	J/mol×K	948.76	Joback Calculated Property
Cp,gas	841.98	J/mol×K	983.61	Joback Calculated Property
Cp,gas	850.95	J/mol×K	1018.46	Joback Calculated Property
Cp,gas	858.82	J/mol×K	1053.31	Joback Calculated Property
Cp,gas	865.62	J/mol×K	1088.16	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, di(1-(2,6-difluorophenyl)ethyl) ester.

Sources

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

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