Chemical Properties of Glutaric acid, 2,4,6-trichlorophenyl pentafluorobenzyl ester

Glutaric acid, 2,4,6-trichlorophenyl pentafluorobenzyl ester

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InChI
InChI=1S/C18H10Cl3F5O4/c19-7-4-9(20)18(10(21)5-7)30-12(28)3-1-2-11(27)29-6-8-13(22)15(24)17(26)16(25)14(8)23/h4-5H,1-3,6H2
InChI Key
HAMSANOUJCSSOD-UHFFFAOYSA-N
Formula
C18H10Cl3F5O4
SMILES
O=C(CCCC(=O)Oc1c(Cl)cc(Cl)cc1Cl)OCc1c(F)c(F)c(F)c(F)c1F
Molecular Weight1
491.62
Sources

Physical Properties

Property Value Unit Source
Δf -1229.22 kJ/mol Joback Calculated Property
Δfgas -1550.92 kJ/mol Joback Calculated Property
Δfus 60.91 kJ/mol Joback Calculated Property
Δvap 92.89 kJ/mol Joback Calculated Property
logPoct/wat 6.16 Crippen Calculated Property
Pc 1426.15 kPa Joback Calculated Property
Tboil 965.66 K Joback Calculated Property
Tc 1186.00 K Joback Calculated Property
Tfus 682.65 K Joback Calculated Property
Vc 1.11 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 754.68 J/mol×K 965.66 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-Cl 3
=CH- (ring) 2
=C< (ring) 10
-CH2- 4
-F 5
>C=O (nonring) 2

Similar Compounds

Glutaric acid, 2,3-dichlorophenyl pentafluorobenzyl ester. Succinic acid, 2-chlorophenyl pentafluorobenzyl ester. Glutaric acid, 2-chloro-6-fluorophenyl pentafluorobenzyl ester. 2,4,5-TB PFB ester. Fumaric acid, pentafluorobenzyl 2,4,6-trichlorophenyl ester. 2,4-DP, PFB ester. (2,4-Dichlorophenoxy)acetic acid, pentafluorobenzyl ester. Silvex, PFB ester. Succinic acid, 3,5-difluorophenyl pentafluorobenzyl ester. 2,4,5-T, PFB. Fumaric acid, pentafluorobenzyl 2,3-dichlorophenyl ester. MCPB, PFB. Succinic acid, 2-isopropoxyphenyl pentafluorobenzyl ester. Fumaric acid, pentafluorobenzyl 2-chloro-6-fluorophenyl ester. CPIB PFB ester.

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