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CAS 86030-08-2

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4-chloro-2-nitro-1-(phenylsulfonyl)benzene

Description:
4-Chloro-2-nitro-1-(phenylsulfonyl)benzene, with the CAS number 86030-08-2, is an organic compound characterized by the presence of a chloro group, a nitro group, and a phenylsulfonyl moiety attached to a benzene ring. This compound typically exhibits a solid state at room temperature and is likely to be a pale yellow to light brown crystalline substance. It is known for its potential applications in organic synthesis and as an intermediate in the production of pharmaceuticals and agrochemicals. The presence of both electron-withdrawing groups (the nitro and chloro substituents) and an electron-donating group (the phenylsulfonyl) can influence its reactivity and solubility in various solvents. Additionally, the compound may exhibit moderate to low solubility in water, while being more soluble in organic solvents. Safety data should be consulted for handling, as compounds with similar structures can pose health risks, including toxicity and environmental hazards.
Formula:C12H8ClNO4S
InChI:InChI=1/C12H8ClNO4S/c13-9-6-7-12(11(8-9)14(15)16)19(17,18)10-4-2-1-3-5-10/h1-8H
InChI key:VZDUQPHKUBZMLW-UHFFFAOYSA-N
SMILES:c1ccc(cc1)S(=O)(=O)c1ccc(cc1N(=O)=O)Cl
Synonyms:
  • 4-Chloro-2-nitrodiphenyl sulfone
  • Btb-1
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