Chemical Properties of Diglycolic acid, 2-bromo-4-fluorophenyl pentyl ester

Diglycolic acid, 2-bromo-4-fluorophenyl pentyl ester

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InChI
InChI=1S/C15H18BrFO5/c1-2-3-4-7-21-14(18)9-20-10-15(19)22-13-6-5-11(17)8-12(13)16/h5-6,8H,2-4,7,9-10H2,1H3
InChI Key
PMNQKJUELUVKFP-UHFFFAOYSA-N
Formula
C15H18BrFO5
SMILES
CCCCCOC(=O)COCC(=O)Oc1ccc(F)cc1Br
Molecular Weight1
377.20
Sources

Physical Properties

Property Value Unit Source
Δf -584.76 kJ/mol Joback Calculated Property
Δfgas -930.94 kJ/mol Joback Calculated Property
Δfus 43.00 kJ/mol Joback Calculated Property
Δvap 78.92 kJ/mol Joback Calculated Property
logPoct/wat 3.24 Crippen Calculated Property
Pc 1961.34 kPa Joback Calculated Property
Tboil 819.67 K Joback Calculated Property
Tc 1027.00 K Joback Calculated Property
Tfus 537.21 K Joback Calculated Property
Vc 0.91 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 664.93 J/mol×K 819.67 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 3
-CH3 1
=CH- (ring) 3
=C< (ring) 3
-CH2- 6
-F 1
>C=O (nonring) 2
-Br 1

Similar Compounds

Diglycolic acid, 2-bromo-4-fluorophenyl octyl ester. Diglycolic acid, 2-bromo-4-fluorophenyl nonyl ester. Diglycolic acid, 2-bromo-4-fluorophenyl decyl ester. Diglycolic acid, 2-bromo-4-fluorophenyl ethyl ester. Diglycolic acid, di(2-bromo-4-fluorophenyl) ester. Succinic acid, 2-bromo-4-fluorophenyl 2-ethoxyethyl ester. Succinic acid, 2-bromo-4-fluorophenyl 2-methoxyethyl ester. Sebacic acid, 2-bromo-4-fluorophenyl nonyl ester. Sebacic acid, 2-bromo-4-fluorophenyl octyl ester. Sebacic acid, 2-bromo-4-fluorophenyl decyl ester. Sebacic acid, 2-bromo-4-fluorophenyl heptyl ester. Glutaric acid, 8-chlorooctyl 2-bromo-4-fluorophenyl ester. Succinic acid, 8-chlorooctyl 2-bromo-4-fluorophenyl ester. Sebacic acid, 2-bromo-4-fluorophenyl ethyl ester. Diglycolic acid, 4-bromophenyl pentyl ester.

Find more compounds similar to Diglycolic acid, 2-bromo-4-fluorophenyl pentyl ester.

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