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CS-W001157 4
Total: USD 88.00

6-Chloro-2,4-dimethylnicotinic acid

  • CAS No. 630082-81-4

  • Cat. No. CS-0319678
  • Purity95+%
  • MDL No.None

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

6-Chloro-2,4-dimethylnicotinic acid|CS-0319678

Structure of 630082-81-4

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General Information

  • CAS No. 630082-81-4
  • Cat. No. CS-0319678
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈ClNO₂
  • Molecular Weight 185.61
  • Synonym(s) 6-chloro-2,4-dimethylpyridine-3-carboxylic acid
  • SMILES CC1=C(C(=NC(=C1)Cl)C)C(=O)O

Synthesis

  • Route1
    • Ethyl 6-chloro-2,4-dimethylnicotinate|CS-0151846
      54453-94-0
    • ~89%
    • 6-Chloro-2,4-dimethylnicotinic acid|CS-0319678
      630082-81-4

    References

    • AnorMED Inc. Patent: US2005/277668 A1, 2005 ; Location in patent: Page/Page column 16 ; US 20050277668 A1
  • Route2

    References

    • Crawford, Jason B.; Chen, Gang; Carpenter, Bryon; Wilson, Trevor; Ji, Jenny; Skerlj, Renato T.; Bridger, Gary J. Organic Process Research and Development, 2012 , vol. 16, # 1 p. 109 - 116
  • Route3
    • null|null
      405058-67-5
    • ~%
    • 6-Chloro-2,4-dimethylnicotinic acid|CS-0319678
      630082-81-4

    References

    • Skerlj, Renato; Bridger, Gary; Zhou, Yuanxi; Bourque, Elyse; McEachern, Ernest; Langille, Jonathan; Harwig, Curtis; Veale, Duane; Yang, Wen; Li, Tongshong; Zhu, Yongbao; Bey, Michael; Baird, Ian; Sartori, Michael; Metz, Markus; Mosi, Renee; Nelson, Kim; Bodart, Veronique; Wong, Rebecca; Fricker, Simon; Mac Farland, Ron; Huskens, Dana; Schols, Dominique Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 23 p. 6950 - 6954

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-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.19
  • LogP   2.05004
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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