Chemical Properties of Glutaric acid, 2,6-difluoro-4-bromobenzyl propyl ester

InChI

InChI=1S/C15H17BrF2O4/c1-2-6-21-14(19)4-3-5-15(20)22-9-11-12(17)7-10(16)8-13(11)18/h7-8H,2-6,9H2,1H3

InChI Key

JQNKDIGDFBQVSO-UHFFFAOYSA-N

Formula

C15H17BrF2O4

SMILES

CCCOC(=O)CCCC(=O)OCc1c(F)cc(Br)cc1F

Molecular Weight¹

379.20

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[644.91; 704.71]	J/mol×K	[801.50; 1004.10]
Cp,gas	644.91	J/mol×K	801.50	Joback Calculated Property
Cp,gas	657.00	J/mol×K	835.27	Joback Calculated Property
Cp,gas	668.23	J/mol×K	869.03	Joback Calculated Property
Cp,gas	678.61	J/mol×K	902.80	Joback Calculated Property
Cp,gas	688.14	J/mol×K	936.57	Joback Calculated Property
Cp,gas	696.84	J/mol×K	970.33	Joback Calculated Property
Cp,gas	704.71	J/mol×K	1004.10	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,6-difluoro-4-bromobenzyl propyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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