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CS-W001157 4
Total: USD 88.00

6-(3-Cyanophenyl)nicotinic acid

  • CAS No. 887975-97-5

  • Cat. No. CS-0156934
  • Purity≥95%
  • MDL No.MFCD06410410

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

6-(3-Cyanophenyl)nicotinic acid|CS-0156934

Structure of 887975-97-5

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General Information

  • CAS No. 887975-97-5
  • Cat. No. CS-0156934
  • Purity ≥95%
  • MDL No. MFCD06410410
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₈N₂O₂
  • Molecular Weight 224.21
  • Synonym(s) 6-(3-Cyanophenyl)-nicotinic acid
  • SMILES C1=CC(=CC(=C1)C2=NC=C(C=C2)C(=O)O)C#N

Synthesis

  • Route1
    • null|null
      1033844-96-0
    • ~%
    • 6-(3-Cyanophenyl)nicotinic acid|CS-0156934
      887975-97-5

    References

    • Blake, Tanisha D.; Hamper, Bruce C.; Huang, Wei; Kiefer, James R.; Moon, Joseph B.; Neal, Bradley E.; Olson, Kirk L.; Pelc, Matthew J.; Schweitzer, Barbara A.; Thorarensen, Atli; Trujillo, John I.; Turner, Steven R. Patent: US2008/146569 A1, 2008 ; Location in patent: Page/Page column 153 ; US 20080146569 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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   73.98
  • LogP   2.31848
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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