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N-benzyl-2-bromopropanamide

  • CAS No. 6653-71-0

  • Cat. No. CS-0319629
  • Molecule weight242.11
  • Purity95+%
  • MDL No.None

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

N-benzyl-2-bromopropanamide|CS-0319629

Structure of 6653-71-0

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General Information

  • CAS No. 6653-71-0
  • Cat. No. CS-0319629
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂BrNO
  • Molecular Weight 242.11
  • Synonym(s) (R,S)-2-bromo-N-benzylpropanamide
  • SMILES CC(Br)C(NCC1=CC=CC=C1)=O

Synthesis

  • Route1
    • null|null
      563-76-8
    • null|null
      100-46-9
    • ~%
    • N-benzyl-2-bromopropanamide|CS-0319629
      6653-71-0

    References

    • Chemische Berichte, , vol. 31, p. 3237
  • Route2
    • null|null
      100-46-9
    • null|null
      7148-74-5
    • ~92%
    • N-benzyl-2-bromopropanamide|CS-0319629
      6653-71-0

    References

    • Okawara, Tadashi; Matsuda, Takashi; Furukawa, Mitsuru Chemical and Pharmaceutical Bulletin, 1982 , vol. 30, # 4 p. 1225 - 1233
  • Route3
    • null|null
      100-46-9
    • null|null
      535-11-5
    • ~%
    • N-benzyl-2-bromopropanamide|CS-0319629
      6653-71-0

    References

    • Bioorganic and Medicinal Chemistry, , vol. 9, # 5 p. 1345 - 1348

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS08
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331-H341
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   29.1
  • LogP   2.0862
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   3

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