Chemical Properties of Succinic acid, 2,4,6-trichlorophenyl 3-fluorophenyl ester

InChI

InChI=1S/C16H10Cl3FO4/c17-9-6-12(18)16(13(19)7-9)24-15(22)5-4-14(21)23-11-3-1-2-10(20)8-11/h1-3,6-8H,4-5H2

InChI Key

KIWDPQFDGUFVJB-UHFFFAOYSA-N

Formula

C16H10Cl3FO4

SMILES

O=C(CCC(=O)Oc1c(Cl)cc(Cl)cc1Cl)Oc1cccc(F)c1

Molecular Weight¹

391.61

• 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°	-428.30	kJ/mol	Joback Calculated Property
ΔfH°gas	-679.32	kJ/mol	Joback Calculated Property
ΔfusH°	44.97	kJ/mol	Joback Calculated Property
ΔvapH°	89.06	kJ/mol	Joback Calculated Property
log10WS	-6.13		Crippen Calculated Property
logPoct/wat	5.077		Crippen Calculated Property
McVol	242.150	ml/mol	McGowan Calculated Property
Pc	2036.39	kPa	Joback Calculated Property
Inp	[2555.00; 2555.00]
Inp	2555.00		NIST
Inp	2555.00		NIST
Tboil	902.90	K	Joback Calculated Property
Tc	1140.03	K	Joback Calculated Property
Tfus	607.67	K	Joback Calculated Property
Vc	0.928	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[622.99; 658.96]	J/mol×K	[902.90; 1140.03]
Cp,gas	622.99	J/mol×K	902.90	Joback Calculated Property
Cp,gas	631.74	J/mol×K	942.42	Joback Calculated Property
Cp,gas	639.37	J/mol×K	981.94	Joback Calculated Property
Cp,gas	645.90	J/mol×K	1021.46	Joback Calculated Property
Cp,gas	651.33	J/mol×K	1060.98	Joback Calculated Property
Cp,gas	655.68	J/mol×K	1100.50	Joback Calculated Property
Cp,gas	658.96	J/mol×K	1140.03	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,4,6-trichlorophenyl 3-fluorophenyl ester.

Sources

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

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