Chemical Properties of Glutaric acid, 3,5-difluorophenyl propyl ester

InChI

InChI=1S/C14H16F2O4/c1-2-6-19-13(17)4-3-5-14(18)20-12-8-10(15)7-11(16)9-12/h7-9H,2-6H2,1H3

InChI Key

QOYRRPLSBFHGQM-UHFFFAOYSA-N

Formula

C14H16F2O4

SMILES

CCCOC(=O)CCCC(=O)Oc1cc(F)cc(F)c1

Molecular Weight¹

286.27

• 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°	-697.31	kJ/mol	Joback Calculated Property
ΔfH°gas	-1000.52	kJ/mol	Joback Calculated Property
ΔfusH°	37.01	kJ/mol	Joback Calculated Property
ΔvapH°	67.04	kJ/mol	Joback Calculated Property
log10WS	-3.82		Crippen Calculated Property
logPoct/wat	2.994		Crippen Calculated Property
McVol	202.780	ml/mol	McGowan Calculated Property
Pc	1959.60	kPa	Joback Calculated Property
Inp	[1815.00; 1815.00]
Inp	1815.00		NIST
Inp	1815.00		NIST
Tboil	707.48	K	Joback Calculated Property
Tc	899.73	K	Joback Calculated Property
Tfus	444.50	K	Joback Calculated Property
Vc	0.795	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[554.85; 622.01]	J/mol×K	[707.48; 899.73]
Cp,gas	554.85	J/mol×K	707.48	Joback Calculated Property
Cp,gas	567.96	J/mol×K	739.52	Joback Calculated Property
Cp,gas	580.30	J/mol×K	771.56	Joback Calculated Property
Cp,gas	591.88	J/mol×K	803.61	Joback Calculated Property
Cp,gas	602.68	J/mol×K	835.65	Joback Calculated Property
Cp,gas	612.73	J/mol×K	867.69	Joback Calculated Property
Cp,gas	622.01	J/mol×K	899.73	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 3,5-difluorophenyl propyl ester.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.