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116-29-0

116-29-0 structural image
Product Name: Tetradifon
Formula: C12H6Cl4O2S
Synonyms: 2,4,4′,5-Tetrachlorodiphenyl sulfone
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description White solid; [Hawley] Colorless solid; [ICSC] Technical product: Off-white to slightly yellow solid; [HSDB] White odorless crystalline solid; [MSDSonline]
Color/Form Crystals from benzene
Odor ODORLESS
Melting Point 146.5 - 147.5 °C
Solubility Solubility in acetone 67.3, methanol 3.46, ethyl acetate 67.3, hexane 1.52, dichloromethane 297, xylene 105 (all in g/L, 20 °C)
Density 1.151 @ 20 °C
Vapor Pressure 2.40X10-10 mm Hg at 20 °C
LogP log Kow= 4.61
Henry's Law Constant Henry's Law constant = 1.44X10-9 atm-cu m/mol @ 25 °C /Estimated/
Stability/Shelf Life Stable to concentrated and dilute alkalis, mineral acids, high temperature and UV light.
Decomposition When heated to decomposition it emits toxic fumes of /hydrogen chloride and sulfur oxides/.
Corrosivity NON-CORROSIVE
Kovats Retention Index 2462 2492.2 2447.6 2444.1 2535.7 2488.8 2449 2471 2480.1
Other Experimental Properties Off white to lightly yellowish substance /technical product/
Chemical Classes Pesticides -> Organochlorine Pesticides

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H302:Acute toxicity,oral
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.

COMPUTED DESCRIPTORS

Molecular Weight 356.0 g/mol
XLogP3 5.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 355.881311 g/mol
Monoisotopic Mass 353.884261 g/mol
Topological Polar Surface Area 42.5 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 400
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Tetradifon is a sulfone that is diphenylsulfone in which one of the phenyl groups is substituted by chlorine at position 4, while the other is substituted by a chlorine at positions 2, 4, and 5. It is an organochlorine acaricide, a trichlorobenzene, a sulfone and a member of monochlorobenzenes.