Chemical Properties of Glutaric acid, 2-bromo-5-fluorobenzyl propyl ester

Glutaric acid, 2-bromo-5-fluorobenzyl propyl ester

InChI
InChI=1S/C15H18BrFO4/c1-2-8-20-14(18)4-3-5-15(19)21-10-11-9-12(17)6-7-13(11)16/h6-7,9H,2-5,8,10H2,1H3
InChI Key
LVPUBKGDESYPGY-UHFFFAOYSA-N
Formula
C15H18BrFO4
SMILES
CCCOC(=O)CCCC(=O)OCc1cc(F)ccc1Br
Molecular Weight1
361.20
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Physical Properties

Property Value Unit Source
ΔfH°gas -899.39 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 44.97 kJ/mol Joback Calculated Property
ΔvapH° 91.02 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.755 Crippen Calculated Property
McVol 232.600 ml/mol McGowan Calculated Property
Inp [2211.00; 2211.00]   Show Hide
Inp 2211.00 NIST
Inp 2211.00 NIST
Tboil 629.48 K Relay (1.0) Calculated Property
Tfus 287.33 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [630.25; 693.43] J/mol×K [761.31; 964.97] Show Hide
Cp,gas 630.25 J/mol×K 761.31 Joback Calculated Property
Cp,gas 643.18 J/mol×K 795.25 Joback Calculated Property
Cp,gas 655.12 J/mol×K 829.20 Joback Calculated Property
Cp,gas 666.10 J/mol×K 863.14 Joback Calculated Property
Cp,gas 676.14 J/mol×K 897.08 Joback Calculated Property
Cp,gas 685.24 J/mol×K 931.02 Joback Calculated Property
Cp,gas 693.43 J/mol×K 964.97 Joback Calculated Property

Similar Compounds

Glutaric acid, 2-bromo-5-fluorobenzyl butyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl ethyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl pentyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl isobutyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl hexyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl pentadecyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl dodecyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl nonyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl tetradecyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl heptadecyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl decyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl octyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl tridecyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl heptyl ester. Glutaric acid, 2-bromo-5-fluorobenzyl hexadecyl ester.

Find more compounds similar to Glutaric acid, 2-bromo-5-fluorobenzyl propyl ester.

Sources

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