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CS-W001157 4
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2-Chlorobicyclo[2.2.1]hept-5-ene-2-carbonitrile

  • CAS No. 6945-87-5

  • Cat. No. CS-0212734
  • Purity≥98%
  • MDL No.MFCD01566417

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

2-Chlorobicyclo[2.2.1]hept-5-ene-2-carbonitrile|CS-0212734

Structure of 6945-87-5

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General Information

  • CAS No. 6945-87-5
  • Cat. No. CS-0212734
  • Purity ≥98%
  • MDL No. MFCD01566417
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈ClN
  • Molecular Weight 153.61
  • Synonym(s) 2-CHLORO-2-CYANO-BICYCLO(2,2,1)-HEPT-5-ENE
  • SMILES N#CC1(Cl)C(C2)C=CC2C1

Synthesis

  • Route1
    • rel-(1R,2S,4R)-Bicyclo[2.2.1]hept-5-ene-2-carbonitrile|CS-1661152
      2890-96-2
    • ~%
    • 2-Chlorobicyclo[2.2.1]hept-5-ene-2-carbonitrile|CS-0212734
      6945-87-5
    • 2-Chlorobicyclo[2.2.1]hept-5-ene-2-carbonitrile|CS-0212734
      6945-87-5

    References

    • Organic Letters, , vol. 12, # 12 p. 2810 - 2813
  • Route2
    • null|null
      542-92-7
    • null|null
      920-37-6
    • ~%
    • 2-Chlorobicyclo[2.2.1]hept-5-ene-2-carbonitrile|CS-0212734
      6945-87-5
    • 2-Chlorobicyclo[2.2.1]hept-5-ene-2-carbonitrile|CS-0212734
      6945-87-5

    References

    • Canadian Journal of Chemistry, , vol. 62, p. 1751 - 1766
  • Route3
    • null|null
      77-73-6
    • null|null
      920-37-6
    • ~%
    • 2-Chlorobicyclo[2.2.1]hept-5-ene-2-carbonitrile|CS-0212734
      6945-87-5
    • 2-Chlorobicyclo[2.2.1]hept-5-ene-2-carbonitrile|CS-0212734
      6945-87-5

    References

    • Synthesis, , # 24 art. no. Z80411SS, p. 4077 - 4083

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   23.79
  • LogP   2.08358
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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