Chemical Properties of Succinic acid, 2-chloro-6-fluorophenyl 4-chloro-2-methoxyphenyl ester

InChI

InChI=1S/C17H13Cl2FO5/c1-23-14-9-10(18)5-6-13(14)24-15(21)7-8-16(22)25-17-11(19)3-2-4-12(17)20/h2-6,9H,7-8H2,1H3

InChI Key

WGPGTBUUDUQPNT-UHFFFAOYSA-N

Formula

C17H13Cl2FO5

SMILES

COc1cc(Cl)ccc1OC(=O)CCC(=O)Oc1c(F)cccc1Cl

Molecular Weight¹

387.19

• 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	0.8786		Relay (1.0) Calculated Property
ΔfG°	-512.95	kJ/mol	Joback Calculated Property
ΔfH°gas	-857.64	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	44.55	kJ/mol	Joback Calculated Property
ΔvapH°	111.51	kJ/mol	Relay (1.0) Calculated Property
IE	8.23	eV	Relay (1.0) Calculated Property
log10WS	-5.31		Relay (1.0) Calculated Property
logPoct/wat	4.432		Crippen Calculated Property
McVol	249.870	ml/mol	McGowan Calculated Property
Pc	1903.58	kPa	Joback Calculated Property
Inp	[2772.00; 2772.00]
Inp	2772.00		NIST
Inp	2772.00		NIST
Tboil	642.47	K	Relay (1.0) Calculated Property
Tc	920.72	K	Relay (1.0) Calculated Property
Tfus	366.40	K	Relay (1.0) Calculated Property
Vc	0.907	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[683.97; 722.45]	J/mol×K	[910.77; 1141.30]
Cp,gas	683.97	J/mol×K	910.77	Joback Calculated Property
Cp,gas	693.57	J/mol×K	949.19	Joback Calculated Property
Cp,gas	701.90	J/mol×K	987.61	Joback Calculated Property
Cp,gas	708.96	J/mol×K	1026.04	Joback Calculated Property
Cp,gas	714.74	J/mol×K	1064.46	Joback Calculated Property
Cp,gas	719.24	J/mol×K	1102.88	Joback Calculated Property
Cp,gas	722.45	J/mol×K	1141.30	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-chloro-6-fluorophenyl 4-chloro-2-methoxyphenyl ester.

Sources

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

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