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CS-W001157 4
Total: USD 88.00

(2-Chloropyridin-3-yl)(phenyl)methanone

  • CAS No. 80099-81-6

  • Cat. No. CS-0362845
  • Purity95+%
  • MDL No.None

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

(2-Chloropyridin-3-yl)(phenyl)methanone|CS-0362845

Structure of 80099-81-6

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General Information

  • CAS No. 80099-81-6
  • Cat. No. CS-0362845
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₈ClNO
  • Molecular Weight 217.65
  • Synonym(s) 3-Benzoyl-2-chloropyridine
  • SMILES C1=CC=C(C=C1)C(=O)C2=C(Cl)N=CC=C2

Synthesis

  • Route1
    • null|null
      109-09-1
    • null|null
      98-88-4
    • ~91%
    • (2-Chloropyridin-3-yl)(phenyl)methanone|CS-0362845
      80099-81-6

    References

    • Marquise, Nada; Harford, Philip J.; Chevallier, Floris; Roisnel, Thierry; Dorcet, Vincent; Gagez, Anne-Laure; Sable, Sophie; Picot, Laurent; Thiery, Valerie; Wheatley, Andrew E.H.; Gros, Philippe C.; Mongin, Florence Tetrahedron, 2013 , vol. 69, # 47 p. 10123 - 10133
  • Route2
    • (2-Chloropyridin-3-yl)-phenylmethanol|CS-0753875
      80100-23-8
    • ~90%
    • (2-Chloropyridin-3-yl)(phenyl)methanone|CS-0362845
      80099-81-6

    References

    • Trecourt, Francois; Marsais, Francis; Guengoer, Timur; Queguiner, Guy Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1990 , # 9 p. 2409 - 2415
  • Route3

    References

    • Kobayashi, Kazuhiro; Suzuki, Teruhiko; Horiuchi, Mai; Shiroyama, Yasuhiko; Konishi, Hisatoshi Synthesis, 2011 , # 18 art. no. F53211SS, p. 2897 - 2906

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

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Computational Chemistry Data

  • TPSA   29.96
  • LogP   2.966
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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