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CS-W001157 4
Total: USD 88.00

2-(Pyridin-4-yl)-1-(p-tolyl)ethanone

  • CAS No. 100866-13-5

  • Cat. No. CS-W006796
  • Molecule weight211.26
  • Purity≥95%
  • MDL No.MFCD04114381

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

2-(Pyridin-4-yl)-1-(p-tolyl)ethanone|CS-W006796

Structure of 100866-13-5

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General Information

  • CAS No. 100866-13-5
  • Cat. No. CS-W006796
  • Purity ≥95%
  • MDL No. MFCD04114381
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₃NO
  • Molecular Weight 211.26
  • Synonym(s) 2-PYRIDIN-4-YL-1-P-TOLYL-ETHANONE
  • SMILES CC1=CC=C(C(CC2=CC=NC=C2)=O)C=C1

Synthesis

  • Route1
    • null|null
      108-89-4
    • (2-Methylaziridin-1-yl)(P-tolyl)methanone|CS-1156070
      21384-44-1
    • ~70%
    • 2-(Pyridin-4-yl)-1-(p-tolyl)ethanone|CS-W006796
      100866-13-5

    References

    • Miwatashi, Seiji; Arikawa, Yasuyoshi; Naruo, Ken-Ichi; Igaki, Keiko; Watanabe, Yasumasa; Kimura, Hiroyuki; Kawamoto, Tomohiro; Ohkawa, Shigenori Chemical and Pharmaceutical Bulletin, 2005 , vol. 53, # 4 p. 410 - 418
  • Route2

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 20, # 8 p. 2634 - 2638
  • Route3
    • null|null
      110531-58-3
    • ~%
    • 2-(Pyridin-4-yl)-1-(p-tolyl)ethanone|CS-W006796
      100866-13-5

    References

    • Justus Liebigs Annalen der Chemie, , vol. 600, p. 176,188

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   29.96
  • LogP   2.81542
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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