Chemical Properties of Succinic acid, 2-chloro-6-fluorophenyl pentafluorophenyl ester

InChI

InChI=1S/C16H7ClF6O4/c17-6-2-1-3-7(18)15(6)26-8(24)4-5-9(25)27-16-13(22)11(20)10(19)12(21)14(16)23/h1-3H,4-5H2

InChI Key

RHPSIAFXFYJZGT-UHFFFAOYSA-N

Formula

C16H7ClF6O4

SMILES

O=C(CCC(=O)Oc1c(F)c(F)c(F)c(F)c1F)Oc1c(F)cccc1Cl

Molecular Weight¹

412.67

• 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°	-1407.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-1662.80	kJ/mol	Joback Calculated Property
ΔfusH°	50.81	kJ/mol	Joback Calculated Property
ΔvapH°	78.19	kJ/mol	Joback Calculated Property
log10WS	-6.42		Crippen Calculated Property
logPoct/wat	4.466		Crippen Calculated Property
McVol	226.520	ml/mol	McGowan Calculated Property
Pc	1718.88	kPa	Joback Calculated Property
Inp	[2059.00; 2059.00]
Inp	2059.00		NIST
Inp	2059.00		NIST
Tboil	839.33	K	Joback Calculated Property
Tc	1041.55	K	Joback Calculated Property
Tfus	588.34	K	Joback Calculated Property
Vc	0.920	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[616.79; 658.12]	J/mol×K	[839.33; 1041.55]
Cp,gas	616.79	J/mol×K	839.33	Joback Calculated Property
Cp,gas	625.83	J/mol×K	873.03	Joback Calculated Property
Cp,gas	634.02	J/mol×K	906.74	Joback Calculated Property
Cp,gas	641.35	J/mol×K	940.44	Joback Calculated Property
Cp,gas	647.82	J/mol×K	974.15	Joback Calculated Property
Cp,gas	653.41	J/mol×K	1007.85	Joback Calculated Property
Cp,gas	658.12	J/mol×K	1041.55	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-chloro-6-fluorophenyl pentafluorophenyl ester.

Sources

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

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