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CS-W001157 4
Total: USD 88.00

PHT-DL-VAL-OH

  • CAS No. 5115-65-1

  • Cat. No. CS-0372490
  • Purity≥98%
  • MDL No.None

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

PHT-DL-VAL-OH|CS-0372490

Structure of 5115-65-1

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General Information

  • CAS No. 5115-65-1
  • Cat. No. CS-0372490
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₃NO₄
  • Molecular Weight 247.25
  • Synonym(s) 2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-methylbutanoic acid
  • SMILES O=C(C(C(C)C)N1C(C2=C(C1=O)C=CC=C2)=O)O

Synthesis

  • Route1
    • null|null
      85-44-9
    • DL-Valine, ≥97%|CS-1268952
      516-06-3
    • ~80%
    • PHT-DL-VAL-OH|CS-0372490
      5115-65-1

    References

    • Roy, Atanu; Bar, Narayan C.; Achari, Basudeb; Mandal, Sukhendu B. Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1998 , vol. 37, # 7 p. 644 - 650
  • Route2

    References

    • Aitken, R. Alan; Cooper, Harris R.; Mehrotra, Amit P. Journal of the Chemical Society - Perkin Transactions 1, 1996 , # 5 p. 475 - 483

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS09
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H400
Precautionary Statements : P273

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Computational Chemistry Data

  • TPSA   74.68
  • LogP   1.3918
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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