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

InChI

InChI=1S/C17H13ClF2O5/c1-23-14-9-10(19)5-6-13(14)24-15(21)7-8-16(22)25-17-11(18)3-2-4-12(17)20/h2-6,9H,7-8H2,1H3

InChI Key

UCTVNSHFNIVOCM-UHFFFAOYSA-N

Formula

C17H13ClF2O5

SMILES

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

Molecular Weight¹

370.73

• 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	0.8667		Relay (1.0) Calculated Property
ΔfG°	-695.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-999.80	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	43.43	kJ/mol	Joback Calculated Property
ΔvapH°	106.73	kJ/mol	Relay (1.0) Calculated Property
IE	8.24	eV	Relay (1.0) Calculated Property
log10WS	-5.00		Relay (1.0) Calculated Property
logPoct/wat	3.918		Crippen Calculated Property
McVol	239.400	ml/mol	McGowan Calculated Property
Pc	1890.36	kPa	Joback Calculated Property
Inp	[2494.00; 2494.00]
Inp	2494.00		NIST
Inp	2494.00		NIST
Tboil	629.67	K	Relay (1.0) Calculated Property
Tc	900.33	K	Relay (1.0) Calculated Property
Tfus	363.29	K	Relay (1.0) Calculated Property
Vc	0.881	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[671.55; 717.23]	J/mol×K	[872.61; 1093.26]
Cp,gas	671.55	J/mol×K	872.61	Joback Calculated Property
Cp,gas	682.10	J/mol×K	909.38	Joback Calculated Property
Cp,gas	691.49	J/mol×K	946.16	Joback Calculated Property
Cp,gas	699.70	J/mol×K	982.93	Joback Calculated Property
Cp,gas	706.73	J/mol×K	1019.71	Joback Calculated Property
Cp,gas	712.58	J/mol×K	1056.48	Joback Calculated Property
Cp,gas	717.23	J/mol×K	1093.26	Joback Calculated Property

Similar Compounds

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

Sources

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

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