Chemical Properties of Succinic acid, di(3-fluorophenyl) ester

InChI

InChI=1S/C16H12F2O4/c17-11-3-1-5-13(9-11)21-15(19)7-8-16(20)22-14-6-2-4-12(18)10-14/h1-6,9-10H,7-8H2

InChI Key

YEJDQOHATKVRNS-UHFFFAOYSA-N

Formula

C16H12F2O4

SMILES

O=C(CCC(=O)Oc1cccc(F)c1)Oc1cccc(F)c1

Molecular Weight¹

306.26

• 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°	-568.06	kJ/mol	Joback Calculated Property
ΔfH°gas	-805.27	kJ/mol	Joback Calculated Property
ΔfusH°	36.23	kJ/mol	Joback Calculated Property
ΔvapH°	73.76	kJ/mol	Joback Calculated Property
log10WS	-4.41		Crippen Calculated Property
logPoct/wat	3.256		Crippen Calculated Property
McVol	207.200	ml/mol	McGowan Calculated Property
Pc	2224.99	kPa	Joback Calculated Property
Inp	[2139.00; 2139.00]
Inp	2139.00		NIST
Inp	2139.00		NIST
Tboil	779.92	K	Joback Calculated Property
Tc	999.04	K	Joback Calculated Property
Tfus	493.46	K	Joback Calculated Property
Vc	0.799	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[572.54; 630.66]	J/mol×K	[779.92; 999.04]
Cp,gas	572.54	J/mol×K	779.92	Joback Calculated Property
Cp,gas	584.77	J/mol×K	816.44	Joback Calculated Property
Cp,gas	595.96	J/mol×K	852.96	Joback Calculated Property
Cp,gas	606.13	J/mol×K	889.48	Joback Calculated Property
Cp,gas	615.29	J/mol×K	926.00	Joback Calculated Property
Cp,gas	623.46	J/mol×K	962.52	Joback Calculated Property
Cp,gas	630.66	J/mol×K	999.04	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, di(3-fluorophenyl) ester.

Sources

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

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