Chemical Properties of Glutaric acid, 2-fluorophenyl 2,4-dichloro-1-naphthyl ester

InChI

InChI=1S/C21H15Cl2FO4/c22-15-12-16(23)21(14-7-2-1-6-13(14)15)28-20(26)11-5-10-19(25)27-18-9-4-3-8-17(18)24/h1-4,6-9,12H,5,10-11H2

InChI Key

ITIQFMYHGXYJGN-UHFFFAOYSA-N

Formula

C21H15Cl2FO4

SMILES

O=C(CCCC(=O)Oc1c(Cl)cc(Cl)c2ccccc12)Oc1ccccc1F

Molecular Weight¹

421.25

• 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°	-267.62	kJ/mol	Joback Calculated Property
ΔfH°gas	-575.71	kJ/mol	Joback Calculated Property
ΔfusH°	50.74	kJ/mol	Joback Calculated Property
ΔvapH°	97.44	kJ/mol	Joback Calculated Property
log10WS	-7.67		Crippen Calculated Property
logPoct/wat	5.967		Crippen Calculated Property
McVol	280.900	ml/mol	McGowan Calculated Property
Pc	1716.03	kPa	Joback Calculated Property
Inp	[3232.00; 3232.00]
Inp	3232.00		NIST
Inp	3232.00		NIST
Tboil	998.85	K	Joback Calculated Property
Tc	1241.33	K	Joback Calculated Property
Tfus	666.80	K	Joback Calculated Property
Vc	1.081	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[801.11; 843.67]	J/mol×K	[998.85; 1241.33]
Cp,gas	801.11	J/mol×K	998.85	Joback Calculated Property
Cp,gas	810.64	J/mol×K	1039.26	Joback Calculated Property
Cp,gas	819.12	J/mol×K	1079.68	Joback Calculated Property
Cp,gas	826.59	J/mol×K	1120.09	Joback Calculated Property
Cp,gas	833.13	J/mol×K	1160.50	Joback Calculated Property
Cp,gas	838.80	J/mol×K	1200.92	Joback Calculated Property
Cp,gas	843.67	J/mol×K	1241.33	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-fluorophenyl 2,4-dichloro-1-naphthyl ester.

Sources

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

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