Chemical Properties of CPIB PFB ester

CPIB PFB ester

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C17H12ClF5O3/c1-17(2,26-9-5-3-8(18)4-6-9)16(24)25-7-10-11(19)13(21)15(23)14(22)12(10)20/h3-6H,7H2,1-2H3
InChI Key
LWCTUOXYEKQVKP-UHFFFAOYSA-N
Formula
C17H12ClF5O3
SMILES
CC(C)(Oc1ccc(Cl)cc1)C(=O)OCc1c(F)c(F)c(F)c(F)c1F
Molecular Weight1
394.72
Other Names
  • Clofibric acid, PFB
Sources

Physical Properties

Property Value Unit Source
Δf -1062.76 kJ/mol Joback Calculated Property
Δfgas -1372.03 kJ/mol Joback Calculated Property
Δfus 41.69 kJ/mol Joback Calculated Property
Δvap 72.53 kJ/mol Joback Calculated Property
logPoct/wat 4.94 Crippen Calculated Property
Pc 1610.29 kPa Joback Calculated Property
Tboil 800.86 K Joback Calculated Property
Tc 1005.98 K Joback Calculated Property
Tfus 538.99 K Joback Calculated Property
Vc 0.94 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 657.84 J/mol×K 800.86 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-CH3 2
=CH- (ring) 4
-F 5
=C< (ring) 8
-CH2- 1
-Cl 1
>C< 1
>C=O (nonring) 1

Similar Compounds

2,4-DP, PFB ester. MCPP PFB ester. Silvex, PFB ester. (2,4-Dichlorophenoxy)acetic acid, pentafluorobenzyl ester. (4-Chloro-2-methylphenoxy)acetic acid, pentafluorobenzyl ester. 2,4,5-T, PFB. MCPB, PFB. Succinic acid, 2-chlorophenyl pentafluorobenzyl ester. Glutaric acid, 2,4,6-trichlorophenyl pentafluorobenzyl ester. 2,4,5-TB PFB ester. Succinic acid, 3,5-difluorophenyl pentafluorobenzyl ester. Succinic acid, 2-isopropoxyphenyl pentafluorobenzyl ester. Fumaric acid, pentafluorobenzyl 4-chloro-3-methylphenyl ester. 2-Ethylbutyric acid, pentafluorobenzyl ester. Fumaric acid, pentafluorobenzyl 3-chlorophenyl ester.

Find more compounds similar to CPIB PFB ester.

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.