Chemical Properties of Succinic acid, 4-chloro-3-methylphenyl 2,3,4-trifluorophenyl ester

InChI

InChI=1S/C17H12ClF3O4/c1-9-8-10(2-3-11(9)18)24-14(22)6-7-15(23)25-13-5-4-12(19)16(20)17(13)21/h2-5,8H,6-7H2,1H3

InChI Key

HZPAQPFRJBXXLX-UHFFFAOYSA-N

Formula

C17H12ClF3O4

SMILES

Cc1cc(OC(=O)CCC(=O)Oc2ccc(F)c(F)c2F)ccc1Cl

Molecular Weight¹

372.72

• 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°	-795.27	kJ/mol	Joback Calculated Property
ΔfH°gas	-1072.17	kJ/mol	Joback Calculated Property
ΔfusH°	44.93	kJ/mol	Joback Calculated Property
ΔvapH°	81.54	kJ/mol	Joback Calculated Property
log10WS	-5.90		Crippen Calculated Property
logPoct/wat	4.357		Crippen Calculated Property
McVol	235.300	ml/mol	McGowan Calculated Property
Pc	1821.61	kPa	Joback Calculated Property
Inp	[2446.00; 2446.00]
Inp	2446.00		NIST
Inp	2446.00		NIST
Tboil	854.44	K	Joback Calculated Property
Tc	1070.35	K	Joback Calculated Property
Tfus	572.80	K	Joback Calculated Property
Vc	0.922	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[652.11; 700.34]	J/mol×K	[854.44; 1070.35]
Cp,gas	652.11	J/mol×K	854.44	Joback Calculated Property
Cp,gas	662.70	J/mol×K	890.42	Joback Calculated Property
Cp,gas	672.26	J/mol×K	926.41	Joback Calculated Property
Cp,gas	680.80	J/mol×K	962.39	Joback Calculated Property
Cp,gas	688.33	J/mol×K	998.38	Joback Calculated Property
Cp,gas	694.84	J/mol×K	1034.36	Joback Calculated Property
Cp,gas	700.34	J/mol×K	1070.35	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 4-chloro-3-methylphenyl 2,3,4-trifluorophenyl ester.

Sources

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

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