Chemical Properties of Succinic acid, 2-fluorophenyl 3-phenoxybenzyl ester

InChI

InChI=1S/C23H19FO5/c24-20-11-4-5-12-21(20)29-23(26)14-13-22(25)27-16-17-7-6-10-19(15-17)28-18-8-2-1-3-9-18/h1-12,15H,13-14,16H2

InChI Key

HHJUWODPRZWAEE-UHFFFAOYSA-N

Formula

C23H19FO5

SMILES

O=C(CCC(=O)Oc1ccccc1F)OCc1cccc(Oc2ccccc2)c1

Molecular Weight¹

394.39

• 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°	-306.90	kJ/mol	Joback Calculated Property
ΔfH°gas	-649.33	kJ/mol	Joback Calculated Property
ΔfusH°	46.51	kJ/mol	Joback Calculated Property
ΔvapH°	94.85	kJ/mol	Joback Calculated Property
log10WS	-5.98		Crippen Calculated Property
logPoct/wat	5.047		Crippen Calculated Property
McVol	286.170	ml/mol	McGowan Calculated Property
Pc	1689.34	kPa	Joback Calculated Property
Inp	[2979.00; 2979.00]
Inp	2979.00		NIST
Inp	2979.00		NIST
Tboil	989.91	K	Joback Calculated Property
Tc	1230.22	K	Joback Calculated Property
Tfus	620.41	K	Joback Calculated Property
Vc	1.083	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[882.09; 922.21]	J/mol×K	[989.91; 1230.22]
Cp,gas	882.09	J/mol×K	989.91	Joback Calculated Property
Cp,gas	892.53	J/mol×K	1029.96	Joback Calculated Property
Cp,gas	901.41	J/mol×K	1070.01	Joback Calculated Property
Cp,gas	908.78	J/mol×K	1110.06	Joback Calculated Property
Cp,gas	914.67	J/mol×K	1150.12	Joback Calculated Property
Cp,gas	919.13	J/mol×K	1190.17	Joback Calculated Property
Cp,gas	922.21	J/mol×K	1230.22	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-fluorophenyl 3-phenoxybenzyl ester.

Sources

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

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