Chemical Properties of Glutaric acid, 2-chloro-6-fluorophenyl 2-propylphenyl ester

InChI

InChI=1S/C20H20ClFO4/c1-2-7-14-8-3-4-11-17(14)25-18(23)12-6-13-19(24)26-20-15(21)9-5-10-16(20)22/h3-5,8-11H,2,6-7,12-13H2,1H3

InChI Key

ATTZEQBVDLLULU-UHFFFAOYSA-N

Formula

C20H20ClFO4

SMILES

CCCc1ccccc1OC(=O)CCCC(=O)Oc1c(F)cccc1Cl

Molecular Weight¹

378.82

• 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°	-361.13	kJ/mol	Joback Calculated Property
ΔfH°gas	-718.93	kJ/mol	Joback Calculated Property
ΔfusH°	47.32	kJ/mol	Joback Calculated Property
ΔvapH°	88.53	kJ/mol	Joback Calculated Property
log10WS	-6.40		Crippen Calculated Property
logPoct/wat	5.113		Crippen Calculated Property
McVol	274.030	ml/mol	McGowan Calculated Property
Pc	1586.01	kPa	Joback Calculated Property
Inp	[2638.00; 2638.00]
Inp	2638.00		NIST
Inp	2638.00		NIST
Tboil	914.58	K	Joback Calculated Property
Tc	1137.74	K	Joback Calculated Property
Tfus	580.39	K	Joback Calculated Property
Vc	1.054	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[809.25; 864.30]	J/mol×K	[914.58; 1137.74]
Cp,gas	809.25	J/mol×K	914.58	Joback Calculated Property
Cp,gas	821.41	J/mol×K	951.77	Joback Calculated Property
Cp,gas	832.35	J/mol×K	988.97	Joback Calculated Property
Cp,gas	842.07	J/mol×K	1026.16	Joback Calculated Property
Cp,gas	850.62	J/mol×K	1063.35	Joback Calculated Property
Cp,gas	858.02	J/mol×K	1100.55	Joback Calculated Property
Cp,gas	864.30	J/mol×K	1137.74	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-chloro-6-fluorophenyl 2-propylphenyl ester.

Sources

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

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