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

InChI

InChI=1S/C17H14F2O4/c18-12-4-1-6-14(10-12)22-16(20)8-3-9-17(21)23-15-7-2-5-13(19)11-15/h1-2,4-7,10-11H,3,8-9H2

InChI Key

VRDCLTDCFLVVNE-UHFFFAOYSA-N

Formula

C17H14F2O4

SMILES

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

Molecular Weight¹

320.29

• 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°	-559.64	kJ/mol	Joback Calculated Property
ΔfH°gas	-825.91	kJ/mol	Joback Calculated Property
ΔfusH°	38.82	kJ/mol	Joback Calculated Property
ΔvapH°	75.99	kJ/mol	Joback Calculated Property
log10WS	-4.83		Crippen Calculated Property
logPoct/wat	3.646		Crippen Calculated Property
McVol	221.290	ml/mol	McGowan Calculated Property
Pc	2036.39	kPa	Joback Calculated Property
Inp	[2328.00; 2328.00]
Inp	2328.00		NIST
Inp	2328.00		NIST
Tboil	802.80	K	Joback Calculated Property
Tc	1019.43	K	Joback Calculated Property
Tfus	504.73	K	Joback Calculated Property
Vc	0.856	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[626.78; 686.27]	J/mol×K	[802.80; 1019.43]
Cp,gas	626.78	J/mol×K	802.80	Joback Calculated Property
Cp,gas	639.31	J/mol×K	838.91	Joback Calculated Property
Cp,gas	650.76	J/mol×K	875.01	Joback Calculated Property
Cp,gas	661.16	J/mol×K	911.12	Joback Calculated Property
Cp,gas	670.54	J/mol×K	947.22	Joback Calculated Property
Cp,gas	678.90	J/mol×K	983.33	Joback Calculated Property
Cp,gas	686.27	J/mol×K	1019.43	Joback Calculated Property

Similar Compounds

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

Sources

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

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