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

InChI

InChI=1S/C17H13Cl2FO4/c1-10-5-6-14(12(19)9-10)23-15(21)7-8-16(22)24-17-11(18)3-2-4-13(17)20/h2-6,9H,7-8H2,1H3

InChI Key

XJFSJUHMMYWXOT-UHFFFAOYSA-N

Formula

C17H13Cl2FO4

SMILES

Cc1ccc(OC(=O)CCC(=O)Oc2c(F)cccc2Cl)c(Cl)c1

Molecular Weight¹

371.19

• 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	0.8291		Relay (1.0) Calculated Property
ΔfG°	-407.95	kJ/mol	Joback Calculated Property
ΔfH°gas	-756.80	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	43.36	kJ/mol	Joback Calculated Property
ΔvapH°	107.49	kJ/mol	Relay (1.0) Calculated Property
IE	8.28	eV	Relay (1.0) Calculated Property
log10WS	-5.68		Relay (1.0) Calculated Property
logPoct/wat	4.732		Crippen Calculated Property
McVol	244.000	ml/mol	McGowan Calculated Property
Pc	1932.13	kPa	Joback Calculated Property
Inp	[2611.00; 2611.00]
Inp	2611.00		NIST
Inp	2611.00		NIST
Tboil	623.72	K	Relay (1.0) Calculated Property
Tc	917.70	K	Relay (1.0) Calculated Property
Tfus	359.53	K	Relay (1.0) Calculated Property
Vc	0.889	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[659.26; 703.87]	J/mol×K	[888.35; 1120.07]
Cp,gas	659.26	J/mol×K	888.35	Joback Calculated Property
Cp,gas	669.53	J/mol×K	926.97	Joback Calculated Property
Cp,gas	678.65	J/mol×K	965.59	Joback Calculated Property
Cp,gas	686.63	J/mol×K	1004.21	Joback Calculated Property
Cp,gas	693.48	J/mol×K	1042.83	Joback Calculated Property
Cp,gas	699.23	J/mol×K	1081.45	Joback Calculated Property
Cp,gas	703.87	J/mol×K	1120.07	Joback Calculated Property

Similar Compounds

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

Sources

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

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