Chemical Properties of Phenoxathiin, 2-chloro- (CAS 10230-34-9)

Phenoxathiin, 2-chloro-

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InChI
InChI=1S/C12H7ClOS/c13-8-5-6-10-12(7-8)15-11-4-2-1-3-9(11)14-10/h1-7H
InChI Key
QQGJRVZIBGEUGZ-UHFFFAOYSA-N
Formula
C12H7ClOS
SMILES
Clc1ccc2c(c1)Sc1ccccc1O2
Molecular Weight1
234.70
CAS
10230-34-9
Other Names
  • 2-Chlorophenoxathiin
Sources

Physical Properties

Property Value Unit Source
Δf 268.46 kJ/mol Joback Calculated Property
Δfgas 144.46 kJ/mol Joback Calculated Property
Δfus 28.75 kJ/mol Joback Calculated Property
Δvap 63.60 kJ/mol Joback Calculated Property
IE 7.96 eV NIST
logPoct/wat 4.60 Crippen Calculated Property
Pc 3598.56 kPa Joback Calculated Property
Tboil 661.61 K Joback Calculated Property
Tc 935.83 K Joback Calculated Property
Tfus 481.04 K Joback Calculated Property
Vc 0.57 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 350.94 J/mol×K 661.61 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Phenoxathiin. Phenol], 2,2'-thiobis[4-chloro-. 2-Methylphenoxathiin. 2-Fluorophenoxathiin. 6-(Dimethylaminomethyl)-2,2'-thio-bis-(4-chlorophenol). 2,2'-Thiodiphenol. 2,2'-Thiobis(4-chloro-6-cyclohexylphenol). 2,2'-Thiobis[4-fluorophenol]. 2,2'-Thiodi-p-cresol. Tetrasul. 2,2'-Sulfinyldi-p-cresol. Sodium 5-chloro-2-hydroxy-benzenesulfonate. 4,6-Dichloro-1-phenol-2-sulfonic acid, sodium salt. Tetrasul sulfoxide. 2-(2',4',6'-Trichlorophenoxy)-4-methylthio-aceto-phenone.

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