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CS-W001157 4
Total: USD 88.00

3-Ethylpicolinic acid

  • CAS No. 4116-88-5

  • Cat. No. CS-0124018
  • Molecule weight151.16
  • Purity≥97%
  • MDL No.None

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

3-Ethylpicolinic acid|CS-0124018

Structure of 4116-88-5

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General Information

  • CAS No. 4116-88-5
  • Cat. No. CS-0124018
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NO₂
  • Molecular Weight 151.16
  • Synonym(s) 3-Ethylpyridine-2-carboxylic acid
  • SMILES O=C(C1=NC=CC=C1CC)O

Synthesis

  • Route1

    References

    • BRISTOL-MYERS SQUIBB COMPANY; PACK, Shawn, K.; TYMONKO, Steven; PATEL, Bharat, P.; NATALIE, JR., Kenneth, J.; BELEMA, Makonen Patent: WO2011/59850 A1, 2011 ;
  • Route2
    • null|null
      157865-84-4
    • ~%
    • 3-Ethylpicolinic acid|CS-0124018
      4116-88-5

    References

    • BRISTOL-MYERS SQUIBB COMPANY; PACK, Shawn, K.; TYMONKO, Steven; PATEL, Bharat, P.; NATALIE, JR., Kenneth, J.; BELEMA, Makonen Patent: WO2011/59850 A1, 2011 ;
  • Route3
    • 3-Ethylpicolinaldehyde|CS-0650795
      98491-40-8
    • ~%
    • 3-Ethylpicolinic acid|CS-0124018
      4116-88-5

    References

    • Nakashima Yakugaku Zasshi, 1958 , vol. 78, p. 661,665 Chem.Abstr., 1958 , p. 18399

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

Quality Control

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Computational Chemistry Data

  • TPSA   50.19
  • LogP   1.3422
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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