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CS-W001157 4
Total: USD 88.00

4-Chloro-3-fluoroaniline

  • CAS No. 367-22-6

  • Cat. No. CS-W002747
  • Purity≥98%
  • MDL No.MFCD01090987

*For research and further manufacturing use only, not for direct human use.

4-Chloro-3-fluoroaniline|CS-W002747

Structure of 367-22-6

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General Information

  • CAS No. 367-22-6
  • Cat. No. CS-W002747
  • Purity ≥98%
  • MDL No. MFCD01090987
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₅ClFN
  • Molecular Weight 145.56
  • Synonym(s) 4-CHLORO-3-FLUORO-PHENYLAMINE
  • SMILES ClC1=C(F)C=C(N)C=C1

Description

4-Chloro-3-fluoroaniline features a strategically positioned chlorine and fluorine substituent on the aromatic ring, enabling precise tuning of electronic properties. This electron-deficient aniline derivative integrates readily into pharmaceutical intermediates and functional materials, offering enhanced reactivity in coupling processes under standard conditions.

Application

4-Chloro-3-fluoroaniline serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling efficient access to fluorinated aromatic scaffolds. Its ortho-halogenated aniline motif facilitates palladium-catalyzed cross-coupling reactions and provides enhanced metabolic stability in bioactive molecules. The compound exhibits good bench stability and compatibility with diverse functional groups, simplifying purification and downstream derivatization in multi-step syntheses.

Synthesis

  • Route1
    • null|null
      372-19-0
    • ~29%
    • In-stock
      4-Chloro-3-fluoroaniline|CS-W002747
      367-22-6

    References

    • Okamoto, Osamu; Kobayashi, Kensuke; Kawamoto, Hiroshi; Ito, Satoru; Yoshizumi, Takashi; Yamamoto, Izumi; Hashimoto, Masaya; Shimizu, Atsushi; Takahashi, Hiroyuki; Ishii, Yasuyuki; Ozaki, Satoshi; Ohta, Hisashi Bioorganic and Medicinal Chemistry Letters, 2008 , vol. 18, # 11 p. 3282 - 3285
  • Route2

    References

    • Ji, Pengju; Atherton, John H.; Page, Michael I. Journal of Organic Chemistry, 2012 , vol. 77, # 17 p. 7471 - 7478
  • Route3
    • null|null
      277301-97-0
    • ~98%
    • In-stock
      4-Chloro-3-fluoroaniline|CS-W002747
      367-22-6

    References

    • Silvestri, Romano; Martino, Gabriella De; Sbardella, Gianluca Organic Preparations and Procedures International, 2002 , vol. 34, # 5 p. 517 - 520

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302-H311+H331-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361+P364-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   2.0613
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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