Chemical Properties of 3,4-Dichlorophenyl-4-chlorobenzene sulfonate (CAS 13631-45-3)

3,4-Dichlorophenyl-4-chlorobenzene sulfonate

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InChI
InChI=1S/C12H7Cl3O3S/c13-8-1-4-10(5-2-8)19(16,17)18-9-3-6-11(14)12(15)7-9/h1-7H
InChI Key
OZDJFELGKCBAJR-UHFFFAOYSA-N
Formula
C12H7Cl3O3S
SMILES
O=S(=O)(Oc1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1
Molecular Weight1
337.61
CAS
13631-45-3
Sources

Physical Properties

Property Value Unit Source
Δf -363.24 kJ/mol Joback Calculated Property
Δfgas -485.15 kJ/mol Joback Calculated Property
Δfus 38.91 kJ/mol Joback Calculated Property
Δvap 83.04 kJ/mol Joback Calculated Property
logPoct/wat 4.41 Crippen Calculated Property
Pc 3356.75 kPa Joback Calculated Property
Tboil 724.75 K Joback Calculated Property
Tc 970.62 K Joback Calculated Property
Tfus 465.95 K Joback Calculated Property
Vc 0.78 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 452.56 J/mol×K 724.75 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 3
=CH- (ring) 7
=C< (ring) 5
-S- 1
=O 2

Similar Compounds

Benzenesulfonic acid, 4-chloro-, 4-chlorophenyl ester. Phenyl p-chloro-benzene sulfonate. 4-Chlorophenylbenzenesulfonate. 2,4-Dichlorophenylbenzene sulfonate. P-chlorophenyl-p-toluenesulfonate. 2,4-Dichloro-1-naphthyl 4-chlorobenzenesulfonate. 4-Tert-butylphenyl benzene sulfonate. 3,4-Dichlorophenyl methanesulfonate. 4-Chlorobenzenesulfonic acid. Methylsulfonic acid, 2,4,5-trichlorophenyl ester. Methylsulfonic acid, 2,3,4,6-tetrachlorophenyl ester. Benzenesulfonic acid, p-chloro-,sodium salt. 4,6-Dichloro-1-phenol-2-sulfonic acid, sodium salt. Sodium 5-chloro-2-hydroxy-benzenesulfonate. Benzenesulfonic acid, 4-hydroxy-.

Find more compounds similar to 3,4-Dichlorophenyl-4-chlorobenzene sulfonate.

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