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CAS 175278-46-3

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2-(Cyclohexylthio)-5-nitrobenzaldehyde

Description:
2-(Cyclohexylthio)-5-nitrobenzaldehyde is an organic compound characterized by the presence of a nitro group and a benzaldehyde functional group, along with a cyclohexylthio substituent. This compound features a benzene ring with a nitro group (–NO2) positioned at the 5th carbon and an aldehyde group (–CHO) at the 1st carbon, while the cyclohexylthio group (–S–C6H11) is attached to the 2nd carbon of the benzene ring. The presence of the nitro group typically imparts electron-withdrawing properties, influencing the compound's reactivity and potential applications in organic synthesis. The cyclohexylthio moiety can enhance the lipophilicity of the molecule, potentially affecting its solubility and interaction with biological systems. This compound may be of interest in various fields, including medicinal chemistry and materials science, due to its unique structural features that can facilitate the development of novel chemical entities. Safety and handling precautions should be observed, as with many organic compounds, due to potential toxicity and reactivity.
Formula:C13H15NO3S
InChI:InChI=1/C13H15NO3S/c15-9-10-8-11(14(16)17)6-7-13(10)18-12-4-2-1-3-5-12/h6-9,12H,1-5H2
InChI key:InChIKey=KKPVOEAECFNQNB-UHFFFAOYSA-N
SMILES:S(C1=C(C=O)C=C(N(=O)=O)C=C1)C2CCCCC2
Synonyms:
  • 2-(Cyclohexylsulfanyl)-5-Nitrobenzaldehyde
  • 2-(Cyclohexylsulfanyl)-5-nitrobenzenecarbaldehyde
  • 6-Cyclohexylthio-3-nitrobenzaldehyde
  • Benzaldehyde, 2-(cyclohexylthio)-5-nitro-
  • 2-(Cyclohexylthio)-5-nitrobenzaldehyde
  • TIMTEC-BB SBB002347
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