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6-(3-Phenylpropanamido)hexanoic acid

  • CAS No. 178622-38-3

  • Cat. No. CS-0448614
  • Purity≥98%
  • MDL No.None

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

6-(3-Phenylpropanamido)hexanoic acid|CS-0448614

Structure of 178622-38-3

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General Information

  • CAS No. 178622-38-3
  • Cat. No. CS-0448614
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₂₁NO₃
  • Molecular Weight 263.33
  • Synonym(s) 6-(3-phenylpropanoylamino)hexanoic Acid
  • SMILES O=C(O)CCCCCNC(CCC1=CC=CC=C1)=O

Synthesis

  • Route1

    References

    • Johns Hopkins University School of Medicine Patent: EP1235851 B1, 2006 ; Location in patent: Page/Page column 52 ;
  • Route2

    References

    • Tremblay, Martin R.; Nevalainen, Marta; Nair, Somarajan J.; Porter, James R.; Castro, Alfredo C.; Behnke, Mark L.; Yu, Lin-Chen; Hagel, Margit; White, Kerry; Faia, Kerrie; Grenier, Louis; Campbell, Matthew J.; Cushing, Jill; Woodward, Caroline N.; Hoyt, Jennifer; Foley, Michael A.; Read, Margaret A.; Sydor, Jens R.; Tong, Jeffrey K.; Palombella, Vito J.; McGovern, Karen; Adams, Julian Journal of Medicinal Chemistry, 2008 , vol. 51, # 21 p. 6646 - 6649

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   66.4
  • LogP   2.3804
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   9

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