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CS-W001157 4
Total: USD 88.00

3-Chloro-2-(propan-2-ylsulfanyl)aniline

  • CAS No. 179104-32-6

  • Cat. No. CS-0263042
  • Molecule weight201.72
  • Purity≥97%
  • MDL No.None

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

3-Chloro-2-(propan-2-ylsulfanyl)aniline|CS-0263042

Structure of 179104-32-6

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General Information

  • CAS No. 179104-32-6
  • Cat. No. CS-0263042
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂ClNS
  • Molecular Weight 201.72
  • Synonym(s) 3-Chloro-2-(isopropylthio)aniline
  • SMILES CC(C)SC1=C(C=CC=C1N)Cl

Synthesis

  • Route1
    • (2-Chloro-6-nitrophenyl)(isopropyl)sulfane|CS-0448606
      178551-27-4
    • ~%
    • 3-Chloro-2-(propan-2-ylsulfanyl)aniline|CS-0263042
      179104-32-6

    References

    • Bayer Aktiengesellschaft Patent: US5872300 A1, 1999 ;
  • Route2

    References

    • Bayer Aktiengesellschaft Patent: US5872300 A1, 1999 ;
  • Route3
    • null|null
      3209-22-1
    • ~%
    • 3-Chloro-2-(propan-2-ylsulfanyl)aniline|CS-0263042
      179104-32-6

    References

    • Kunz; Schurter; Maetzke Pesticide Science, 1997 , vol. 50, # 4 p. 275 - 282

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   3.4227
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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