Chemical Properties of Succinic acid, 2-fluorophenyl 2-methoxy-5-methylphenyl ester

InChI

InChI=1S/C18H17FO5/c1-12-7-8-15(22-2)16(11-12)24-18(21)10-9-17(20)23-14-6-4-3-5-13(14)19/h3-8,11H,9-10H2,1-2H3

InChI Key

LJJNWHJIKLNTIV-UHFFFAOYSA-N

Formula

C18H17FO5

SMILES

COc1ccc(C)cc1OC(=O)CCC(=O)Oc1ccccc1F

Molecular Weight¹

332.32

• 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	0.8519		Relay (1.0) Calculated Property
ΔfG°	-471.04	kJ/mol	Joback Calculated Property
ΔfH°gas	-890.40	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	39.13	kJ/mol	Joback Calculated Property
ΔvapH°	105.78	kJ/mol	Relay (1.0) Calculated Property
IE	7.92	eV	Relay (1.0) Calculated Property
log10WS	-4.23		Relay (1.0) Calculated Property
logPoct/wat	3.434		Crippen Calculated Property
McVol	239.480	ml/mol	McGowan Calculated Property
Pc	1892.00	kPa	Joback Calculated Property
Inp	[2492.00; 2492.00]
Inp	2492.00		NIST
Inp	2492.00		NIST
Tboil	638.61	K	Relay (1.0) Calculated Property
Tc	892.58	K	Relay (1.0) Calculated Property
Tfus	363.36	K	Relay (1.0) Calculated Property
Vc	0.887	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[699.68; 756.76]	J/mol×K	[853.81; 1074.95]
Cp,gas	699.68	J/mol×K	853.81	Joback Calculated Property
Cp,gas	712.29	J/mol×K	890.67	Joback Calculated Property
Cp,gas	723.66	J/mol×K	927.52	Joback Calculated Property
Cp,gas	733.79	J/mol×K	964.38	Joback Calculated Property
Cp,gas	742.68	J/mol×K	1001.24	Joback Calculated Property
Cp,gas	750.34	J/mol×K	1038.10	Joback Calculated Property
Cp,gas	756.76	J/mol×K	1074.95	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-fluorophenyl 2-methoxy-5-methylphenyl ester.

Sources

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

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