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CS-W001157 4
Total: USD 88.00

5-(DIFLUOROMETHYL)PICOLINIC ACID

  • CAS No. 859538-41-3

  • Cat. No. CS-0060449
  • Purity≥98%
  • MDL No.None

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

5-(DIFLUOROMETHYL)PICOLINIC ACID|CS-0060449

Structure of 859538-41-3

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General Information

  • CAS No. 859538-41-3
  • Cat. No. CS-0060449
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅F₂NO₂
  • Molecular Weight 173.12
  • Synonym(s) 5-difluoromethyl-pyridine-2-carboxylic acid
  • SMILES C1=CC(=NC=C1C(F)F)C(=O)O

Synthesis

  • Route1

    References

    • Banner, David; Guba, Wolfgang; Hilpert, Hans; Humm, Roland; Mauser, Harald; Mayweg, Alexander V.; Narquizian, Robert; Power, Eoin; Rogers-Evans, Mark; Rombach, Didier; Woltering, Thomas; Wostl, Wolfgang Patent: US2011/312937 A1, 2011 ; Location in patent: Page/Page column 83-84 ;
  • Route2

    References

    • F. HOFFMANN-LA ROCHE AG; SIENA BIOTECH S.P.A.; BANNER, David; GUBA, Wolfgang; HILPERT, Hans; HUMM, Roland; MAUSER, Harald; MAYWEG, Alexander, V.; NARQUIZIAN, Robert; POWER, Eoin; ROGERS-EVANS, Mark; ROMBACH, Didier; WOLTERING, Thomas; WOSTL, Wolfgang Patent: WO2011/138293 A1, 2011 ; WO 2011/138293 A1
  • Route3

    References

    • LEWIS, Richard T.; ALLEN, Jennifer R.; CHENG, Yuan; CHOQUETTE, Deborah; EPSTEIN, Oleg; GUZMAN-PEREZ, Angel; HARRINGTON, Paul E.; HUA, Zihao; HUNGATE, Randall W.; HUMAN, Jason Brooks; JUDD, Ted; LIU, Qingyian; LOPEZ, Patricia; MINATTI, Ana Elena; OLIVIERI, Philip; ROMERO, Karina; RUMFELT, Shannon; RZASA, Robert M.; SCHENKEL, Laurie; STELLWAGEN, John; WHITE, Ryan; XUE, Qiufen; ZHENG, Xiao; ZHONG, Wenge Patent: US2014/107109 A1, 2014 ;

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   1.7174
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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