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

InChI

InChI=1S/C18H16ClFO5/c1-11-9-13(4-5-14(11)19)24-17(21)7-8-18(22)25-15-6-3-12(20)10-16(15)23-2/h3-6,9-10H,7-8H2,1-2H3

InChI Key

OTCBJTWCBXKYGQ-UHFFFAOYSA-N

Formula

C18H16ClFO5

SMILES

COc1cc(F)ccc1OC(=O)CCC(=O)Oc1ccc(Cl)c(C)c1

Molecular Weight¹

366.77

• 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°	-492.60	kJ/mol	Joback Calculated Property
ΔfH°gas	-821.34	kJ/mol	Joback Calculated Property
ΔfusH°	42.94	kJ/mol	Joback Calculated Property
ΔvapH°	87.15	kJ/mol	Joback Calculated Property
log10WS	-5.36		Crippen Calculated Property
logPoct/wat	4.087		Crippen Calculated Property
McVol	251.720	ml/mol	McGowan Calculated Property
Pc	1809.23	kPa	Joback Calculated Property
Inp	[2577.00; 2577.00]
Inp	2577.00		NIST
Inp	2577.00		NIST
Tboil	896.22	K	Joback Calculated Property
Tc	1121.70	K	Joback Calculated Property
Tfus	592.60	K	Joback Calculated Property
Vc	0.961	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[720.05; 767.44]	J/mol×K	[896.22; 1121.70]
Cp,gas	720.05	J/mol×K	896.22	Joback Calculated Property
Cp,gas	731.17	J/mol×K	933.80	Joback Calculated Property
Cp,gas	741.00	J/mol×K	971.38	Joback Calculated Property
Cp,gas	749.55	J/mol×K	1008.96	Joback Calculated Property
Cp,gas	756.81	J/mol×K	1046.54	Joback Calculated Property
Cp,gas	762.78	J/mol×K	1084.12	Joback Calculated Property
Cp,gas	767.44	J/mol×K	1121.70	Joback Calculated Property

Similar Compounds

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

Sources

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

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