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CS-W001157 4
Total: USD 88.00

1-(3-chlorophenyl)propan-1-amine

  • CAS No. 40023-86-7

  • Cat. No. CS-0005312
  • Purity≥95%
  • MDL No.MFCD09431257

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

1-(3-chlorophenyl)propan-1-amine|CS-0005312

Structure of 40023-86-7

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General Information

  • CAS No. 40023-86-7
  • Cat. No. CS-0005312
  • Purity ≥95%
  • MDL No. MFCD09431257
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂ClN
  • Molecular Weight 169.65
  • Synonym(s) None
  • SMILES NC(CC)C1=CC=CC(Cl)=C1

Synthesis

  • Route1

    References

    • SCHERING CORPORATION; PHARMACOPEIA DRUG DISCOVERY, INC. Patent: WO2005/68460 A1, 2005 ; Location in patent: Page/Page column 201 ; WO 2005/068460 A1
  • Route2
    • null|null
      925-90-6
    • ~66%
    • 1-(3-chlorophenyl)propan-1-amine|CS-0005312
      40023-86-7

    References

    • Schering Corporation and Pharmacopeia, Inc. Patent: US2004/147559 A1, 2004 ; Location in patent: Page 121 ; US 20040147559 A1
  • Route3

    References

    • Van Lommen, Guy; Doyon, Julien; Coesemans, Erwin; Boeckx, Staf; Cools, Marina; Buntinx, Mieke; Hermans, Bart; VanWauwe, Jean Bioorganic and Medicinal Chemistry Letters, 2005 , vol. 15, # 3 p. 497 - 500

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   2.7498
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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