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CS-W001157 4
Total: USD 88.00

2,5-Diamino-3-chlorobenzonitrile

  • CAS No. 82997-64-6

  • Cat. No. CS-0364960
  • Purity≥97%
  • MDL No.None

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

2,5-Diamino-3-chlorobenzonitrile|CS-0364960

Structure of 82997-64-6

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General Information

  • CAS No. 82997-64-6
  • Cat. No. CS-0364960
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆ClN₃
  • Molecular Weight 167.60
  • Synonym(s) None
  • SMILES N#CC1=CC(N)=CC(Cl)=C1N

Synthesis

  • Route1
    • 2-Amino-3-chloro-5-nitrobenzonitrile|CS-0204629
      20352-84-5
    • ~10%
    • 2,5-Diamino-3-chlorobenzonitrile|CS-0364960
      82997-64-6

    References

    • H. LUNDBECK A/S Patent: WO2005/87754 A1, 2005 ; Location in patent: Page/Page column 42 ; WO 2005/087754 A1

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
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   75.83
  • LogP   1.37608
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   0

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