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

InChI

InChI=1S/C17H15FO5/c1-21-12-5-4-6-13(11-12)22-16(19)9-10-17(20)23-15-8-3-2-7-14(15)18/h2-8,11H,9-10H2,1H3

InChI Key

VQWMFRFVLPUNJG-UHFFFAOYSA-N

Formula

C17H15FO5

SMILES

COc1cccc(OC(=O)CCC(=O)Oc2ccccc2F)c1

Molecular Weight¹

318.30

• 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	0.8247		Relay (1.0) Calculated Property
ΔfG°	-469.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-860.57	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	36.93	kJ/mol	Joback Calculated Property
ΔvapH°	104.60	kJ/mol	Relay (1.0) Calculated Property
IE	8.16	eV	Relay (1.0) Calculated Property
log10WS	-4.49		Relay (1.0) Calculated Property
logPoct/wat	3.125		Crippen Calculated Property
McVol	225.390	ml/mol	McGowan Calculated Property
Pc	2088.84	kPa	Joback Calculated Property
Inp	[2471.00; 2471.00]
Inp	2471.00		NIST
Inp	2471.00		NIST
Tboil	637.92	K	Relay (1.0) Calculated Property
Tc	887.35	K	Relay (1.0) Calculated Property
Tfus	345.85	K	Relay (1.0) Calculated Property
Vc	0.834	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[645.29; 702.72]	J/mol×K	[825.95; 1048.42]
Cp,gas	645.29	J/mol×K	825.95	Joback Calculated Property
Cp,gas	657.84	J/mol×K	863.03	Joback Calculated Property
Cp,gas	669.19	J/mol×K	900.11	Joback Calculated Property
Cp,gas	679.35	J/mol×K	937.19	Joback Calculated Property
Cp,gas	688.32	J/mol×K	974.26	Joback Calculated Property
Cp,gas	696.11	J/mol×K	1011.34	Joback Calculated Property
Cp,gas	702.72	J/mol×K	1048.42	Joback Calculated Property

Similar Compounds

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

Sources

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

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