Chemical Properties of 2,3,4,6-Tetrachlorophenyl salicylate (CAS 116465-50-0)

2,3,4,6-Tetrachlorophenyl salicylate

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InChI
InChI=1S/C13H6Cl4O3/c14-7-5-8(15)12(11(17)10(7)16)20-13(19)6-3-1-2-4-9(6)18/h1-5,18H
InChI Key
OAZWQPUQRAFSIK-UHFFFAOYSA-N
Formula
C13H6Cl4O3
SMILES
O=C(Oc1c(Cl)cc(Cl)c(Cl)c1Cl)c1ccccc1O
Molecular Weight1
352.00
CAS
116465-50-0
Sources

Physical Properties

Property Value Unit Source
Δf -191.38 kJ/mol Joback Calculated Property
Δfgas -369.54 kJ/mol Joback Calculated Property
Δfus 41.31 kJ/mol Joback Calculated Property
Δvap 91.44 kJ/mol Joback Calculated Property
logPoct/wat 5.23 Crippen Calculated Property
Pc 3028.94 kPa Joback Calculated Property
Tboil 876.75 K Joback Calculated Property
Tc 1141.39 K Joback Calculated Property
Tfus 642.75 K Joback Calculated Property
Vc 0.73 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 482.15 J/mol×K 876.75 Joback Calculated Property
η 0.00 Pa×s 876.75 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 4
=CH- (ring) 5
=C< (ring) 7
>C=O (nonring) 1
-OH (phenol) 1

Similar Compounds

2,4,5-Trichlorophenyl salicylate. Benzoic acid, 2,3,4,6-tetrachlorophenyl ester. 4-Chlorobenzoic acid, 2,3,4,6-tetrachlorophenyl ester. 2-Hydroxybenzoic acid, 2,4-dichlorophenyl ester. 4-Methylbenzoic acid, 2,3,4,6-tetrachlorophenyl ester. Benzoic acid, 2,4,5-trichlorophenyl ester. Benzoic acid, 3-methyl-, 2,3,4,6-tetrachlorophenyl ester. 4-Methoxybenzoic acid, 2,4,5-trichlorophenyl ester. 4-Chlorobenzoic acid, 2,4,5-trichlorophenyl ester. 4-Butylbenzoic acid, 2,3,4,6-tetrachlorophenyl ester. 1-Naphthoic acid, 2,3,4,6-tetrachlorophenyl ester. Isophthalic acid, pentachlorophenyl propyl ester. O-anisic acid, 3,4-dichlorophenyl ester. 2-Chlorobenzoic acid, 2,4,5-trichlorophenyl ester. 4-Butylbenzoic acid, 2,4,5-trichlorophenyl ester.

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