Chemical Properties of 2,4-Dichloro-1-naphthyl 4-chlorobenzenesulfonate (CAS 19361-91-2)

2,4-Dichloro-1-naphthyl 4-chlorobenzenesulfonate

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InChI
InChI=1S/C16H9Cl3O3S/c17-10-5-7-11(8-6-10)23(20,21)22-16-13-4-2-1-3-12(13)14(18)9-15(16)19/h1-9H
InChI Key
DNNCQNJRNQSPCT-UHFFFAOYSA-N
Formula
C16H9Cl3O3S
SMILES
O=S(=O)(Oc1c(Cl)cc(Cl)c2ccccc21)c1ccc(Cl)cc1
Molecular Weight1
387.67
CAS
19361-91-2
Sources

Physical Properties

Property Value Unit Source
Δf -232.54 kJ/mol Joback Calculated Property
Δfgas -388.11 kJ/mol Joback Calculated Property
Δfus 45.90 kJ/mol Joback Calculated Property
Δvap 94.25 kJ/mol Joback Calculated Property
logPoct/wat 5.57 Crippen Calculated Property
Pc 2829.33 kPa Joback Calculated Property
Tboil 840.23 K Joback Calculated Property
Tc 1093.35 K Joback Calculated Property
Tfus 556.25 K Joback Calculated Property
Vc 0.93 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 584.75 J/mol×K 840.23 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 3
=CH- (ring) 9
=C< (ring) 7
-S- 1
=O 2

Similar Compounds

2,4-Dichlorophenylbenzene sulfonate. 3,4-Dichlorophenyl-4-chlorobenzene sulfonate. Benzenesulfonic acid, 4-chloro-, 4-chlorophenyl ester. Phenyl p-chloro-benzene sulfonate. P-chlorophenyl-p-toluenesulfonate. 4-Chlorophenylbenzenesulfonate. 4-Tert-butylphenyl benzene sulfonate. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2,4-dichloro-1-naphthyl ester. Glutaric acid, hex-4-yn-3-yl 2,4-dichloro-1-naphthyl ester. Glutaric acid, 2,4-dichloronaphthyl ethyl ester. Glutaric acid, 2,4-dichloronaphthyl propyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 2,4-dichloronaphth-1-yl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, 2,4-dichloronaphth-1-yl ester. Glutaric acid, 2,2,3,3-tetrafluoropropyl 2,4-dichloro-1-naphthyl ester. 2,6-Difluoro-3-methylbenzoic acid, 2,4-dichloronaphthyl-1 ester.

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