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CAS 99-12-7

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1,3-Dimethyl-5-nitrobenzene

Description:
1,3-Dimethyl-5-nitrobenzene, with the CAS number 99-12-7, is an aromatic compound characterized by a benzene ring substituted with two methyl groups and one nitro group. The methyl groups are located at the 1 and 3 positions, while the nitro group is at the 5 position, giving it a specific structural arrangement that influences its chemical properties. This compound typically appears as a yellow to brown solid and is known for its relatively low solubility in water, but it is soluble in organic solvents such as ethanol and acetone. It exhibits typical aromatic characteristics, including stability and reactivity in electrophilic substitution reactions. The presence of the nitro group introduces electron-withdrawing properties, which can affect the reactivity of the aromatic ring. 1,3-Dimethyl-5-nitrobenzene is used in various applications, including as an intermediate in organic synthesis and in the production of dyes and pharmaceuticals. Safety precautions should be taken when handling this compound, as it may pose health risks if inhaled or ingested.
Formula:C8H9NO2
InChI:InChI=1S/C8H9NO2/c1-6-3-7(2)5-8(4-6)9(10)11/h3-5H,1-2H3
InChI key:InChIKey=BYFNZOKBMZKTSC-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=CC(C)=CC(C)=C1
Synonyms:
  • 1,3-Dimethyl-5-nitrobenzene
  • 1-Nitro-3,5-dimethylbenzene
  • 3,5-Dimethyl-1-nitrobenzene
  • 3,5-Dimethylnitrobenzene
  • 5-Methyl-3-nitrotoluene
  • Benzene, 1,3-dimethyl-5-nitro-
  • NSC 5403
  • Nitroxylol
  • m-Xylene, 5-nitro-
  • 5-Nitro-m-xylene
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