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CS-W001157 4
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1-(6-Chloropyridin-3-yl)cyclopropanecarboxylic acid

  • CAS No. 854267-90-6

  • Cat. No. CS-0088415
  • Molecule weight197.62
  • Purity95+%
  • MDL No.MFCD13188887

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

1-(6-Chloropyridin-3-yl)cyclopropanecarboxylic acid|CS-0088415

Structure of 854267-90-6

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General Information

  • CAS No. 854267-90-6
  • Cat. No. CS-0088415
  • Purity 95+%
  • MDL No. MFCD13188887
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈ClNO₂
  • Molecular Weight 197.62
  • Synonym(s) 1-(6-Chloro-pyridin-3-yl)-cyclopropanecarboxylic acid
  • SMILES OC(C1(C2=CC=C(Cl)N=C2)CC1)=O

Synthesis

  • Route1

    References

    • INCYTE CORPORATION Patent: US2008/39457 A1, 2008 ; Location in patent: Page/Page column 40 ; US 20080039457 A1
  • Route2

    References

    • Isabel, Elise; Bateman, Kevin P.; Chauret, Nathalie; Cromlish, Wanda; Desmarais, Sylvie; Duong, Le T.; Falgueyret, Jean-Pierre; Gauthier, Jacques Yves; Lamontagne, Sonia; Lau, Cheuk K.; Leger, Serge; LeRiche, Tammy; Levesque, Jean-Francois; Li, Chun Sing; Masse, Frederic; McKay, Daniel J.; Mellon, Christophe; Nicoll-Griffith, Deborah A.; Oballa, Renata M.; Percival, M. David; Riendeau, Denis; Robichaud, Joel; Rodan, Gideon A.; Rodan, Sevgi B.; Seto, Carmai; Therien, Michel; Truong, Vouy Linh; Wesolowski, Gregg; Young, Robert N.; Zamboni, Robert; Black, W. Cameron Bioorganic and Medicinal Chemistry Letters, 2010 , vol. 20, # 3 p. 887 - 892
  • Route3

    References

    • IRM LLC; NOVARTIS AG; TELLEW, John Edward; WANG, Xia; WAN, Yongqin; XIE, Yun Feng; PAN, Shifeng; JIANG, Jiqing; XIE, Yongping; HUNT, Thomas Anthony; EDWARDS, Lee; BEATTIE, David; HEALY, Mark Patrick; WEST, Ryan; LISTER, Andrew Stuart Patent: WO2012/138648 A1, 2012 ; Location in patent: Page/Page column 91-92 ; WO 2012/138648 A1

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   50.19
  • LogP   1.8512
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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