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CS-W001157 4
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5-Phenylnicotinic acid

  • CAS No. 10177-12-5

  • Cat. No. CS-0067984
  • Molecule weight199.21
  • Purity≥97%
  • MDL No.MFCD03086176

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

5-Phenylnicotinic acid|CS-0067984

Structure of 10177-12-5

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General Information

  • CAS No. 10177-12-5
  • Cat. No. CS-0067984
  • Purity ≥97%
  • MDL No. MFCD03086176
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₉NO₂
  • Molecular Weight 199.21
  • Synonym(s) 5-Phenylpyridine-3-carboxylic acid, 3-Carboxy-5-phenylpyridine
  • SMILES O=C(C1=CC(C2=CC=CC=C2)=CN=C1)O

Synthesis

  • Route1

    References

    • Carter, Percy H.; Cherney, Robert J.; Batt, Douglas G.; Brown, Gregory D.; Duncia, John V.; Gardner, Daniel S.; Yang, Michael G. Patent: US2005/54626 A1, 2005 ; Location in patent: Page/Page column 43 ; US 20050054626 A1
  • Route2
    • 3-(4,5-Dihydro-4,4-dimethyl-2-oxazolyl)-5-phenylpyridine|CS-0775508
      1254929-25-3
    • ~79%
    • In-stock
      5-Phenylnicotinic acid|CS-0067984
      10177-12-5

    References

    • Jain, Pooja; Slama, James T.; Perez-Haddock, Leroy A.; Walseth, Timothy F. Journal of Medicinal Chemistry, 2010 , vol. 53, # 21 p. 7599 - 7612
  • Route3
    • 3-Methyl-5-phenylpyridine|CS-0205320
      10477-94-8
    • ~%
    • In-stock
      5-Phenylnicotinic acid|CS-0067984
      10177-12-5

    References

    • Journal of the American Chemical Society, , vol. 78, p. 3477,3481

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   2.4468
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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