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CAS 65001-80-1

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1-Bromo-2,4-dichloro-5-nitrobenzene

Description:
1-Bromo-2,4-dichloro-5-nitrobenzene is an aromatic compound characterized by the presence of a bromine atom, two chlorine atoms, and a nitro group attached to a benzene ring. Its molecular structure features a bromine substituent at the first position, chlorine substituents at the second and fourth positions, and a nitro group at the fifth position of the benzene ring. This compound is typically a solid at room temperature and may exhibit a yellow to brown color. It is known for its applications in organic synthesis, particularly as an intermediate in the production of various pharmaceuticals and agrochemicals. The presence of multiple halogen and nitro groups contributes to its reactivity, making it a useful building block in chemical reactions. Additionally, 1-bromo-2,4-dichloro-5-nitrobenzene may pose environmental and health risks, necessitating careful handling and disposal in accordance with safety regulations. Its CAS number, 65001-80-1, is a unique identifier that facilitates its identification in chemical databases and regulatory frameworks.
Formula:C6H2BrCl2NO2
InChI:InChI=1S/C6H2BrCl2NO2/c7-3-1-6(10(11)12)5(9)2-4(3)8/h1-2H
InChI key:InChIKey=SAGMAWQXVPKKAP-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=C(Cl)C=C(Cl)C(Br)=C1
Synonyms:
  • Benzene, 1-bromo-2,4-dichloro-5-nitro-
  • 1-Bromo-2,4-dichloro-5-nitrobenzene
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