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CS-W001157 4
Total: USD 88.00

1-(4-Bromophenyl)guanidine

  • CAS No. 67453-81-0

  • Cat. No. CS-0071401
  • Molecule weight214.06
  • Purity≥97%
  • MDL No.MFCD09996879

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

1-(4-Bromophenyl)guanidine|CS-0071401

Structure of 67453-81-0

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General Information

  • CAS No. 67453-81-0
  • Cat. No. CS-0071401
  • Purity ≥97%
  • MDL No. MFCD09996879
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈BrN₃
  • Molecular Weight 214.06
  • Synonym(s) None
  • SMILES N=C(N)NC(C=C1)=CC=C1Br

Synthesis

  • Route1
    • null|null
      151-51-9
    • null|null
      106-40-1
    • ~58%
    • 1-(4-Bromophenyl)guanidine|CS-0071401
      67453-81-0

    References

    • ASTRAZENECA AB; FORSBLOM, Rickard; PAULSEN, Kim; ROTTICCI, Didier; SANTANGELO, Ellen; WALDMAN, Magnus Patent: WO2010/53438 A1, 2010 ; Location in patent: Page/Page column 91 ; WO 2010/053438 A1
  • Route2

    References

    • Braun; Erit; Crooks Journal of Organic Chemistry, 1938 , vol. 3, p. 146,149 Full Text Show Details King; Tonkin Journal of the Chemical Society, 1946 , p. 1063,1069

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
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UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   61.9
  • LogP   1.75447
  • H_Acceptors   1
  • H_Donors   3
  • Rotatable_Bonds   1

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