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

InChI

InChI=1S/C17H14ClFO5/c1-22-15-10-11(18)6-7-14(15)24-17(21)9-8-16(20)23-13-5-3-2-4-12(13)19/h2-7,10H,8-9H2,1H3

InChI Key

DGIOJXJGVSTXMC-UHFFFAOYSA-N

Formula

C17H14ClFO5

SMILES

COc1cc(Cl)ccc1OC(=O)CCC(=O)Oc1ccccc1F

Molecular Weight¹

352.74

• 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	0.8456		Relay (1.0) Calculated Property
ΔfG°	-491.39	kJ/mol	Joback Calculated Property
ΔfH°gas	-854.92	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	40.74	kJ/mol	Joback Calculated Property
ΔvapH°	107.71	kJ/mol	Relay (1.0) Calculated Property
IE	8.17	eV	Relay (1.0) Calculated Property
log10WS	-4.68		Relay (1.0) Calculated Property
logPoct/wat	3.779		Crippen Calculated Property
McVol	237.630	ml/mol	McGowan Calculated Property
Pc	1992.98	kPa	Joback Calculated Property
Inp	[2585.00; 2585.00]
Inp	2585.00		NIST
Inp	2585.00		NIST
Tboil	644.34	K	Relay (1.0) Calculated Property
Tc	899.96	K	Relay (1.0) Calculated Property
Tfus	360.57	K	Relay (1.0) Calculated Property
Vc	0.870	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[665.73; 713.86]	J/mol×K	[868.36; 1094.78]
Cp,gas	665.73	J/mol×K	868.36	Joback Calculated Property
Cp,gas	676.82	J/mol×K	906.10	Joback Calculated Property
Cp,gas	686.68	J/mol×K	943.83	Joback Calculated Property
Cp,gas	695.31	J/mol×K	981.57	Joback Calculated Property
Cp,gas	702.72	J/mol×K	1019.31	Joback Calculated Property
Cp,gas	708.90	J/mol×K	1057.04	Joback Calculated Property
Cp,gas	713.86	J/mol×K	1094.78	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-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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