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CAS 1199-21-9

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(1-Chloro-2-nitroethenyl)benzene

Description:
(1-Chloro-2-nitroethenyl)benzene, with the CAS number 1199-21-9, is an organic compound characterized by the presence of both a chloro and a nitro group attached to a vinyl group that is further connected to a benzene ring. This compound typically exhibits a yellow to brown color and is likely to be a solid at room temperature. Its structure suggests that it may possess significant reactivity due to the presence of the electron-withdrawing nitro group, which can influence its chemical behavior, particularly in electrophilic substitution reactions. The chloro group can also participate in nucleophilic substitution reactions. The compound is likely to be insoluble in water but soluble in organic solvents, reflecting its hydrophobic nature. Safety data indicates that it may be harmful if inhaled or ingested, and appropriate handling precautions should be taken. Overall, (1-Chloro-2-nitroethenyl)benzene is of interest in organic synthesis and may have applications in the development of pharmaceuticals or agrochemicals.
Formula:C8H6ClNO2
InChI:InChI=1S/C8H6ClNO2/c9-8(6-10(11)12)7-4-2-1-3-5-7/h1-6H
InChI key:InChIKey=NWBAJRDGKGSLMV-UHFFFAOYSA-N
SMILES:C(=CN(=O)=O)(Cl)C1=CC=CC=C1
Synonyms:
  • Styrene, α-chloro-β-nitro-
  • 1-Chloro-2-nitro-1-phenylethylene
  • Benzene, (1-chloro-2-nitroethenyl)-
  • 1-Chloro-1-phenyl-2-nitroethylene
  • (1-Chloro-2-nitroethenyl)benzene
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