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CS-W001157 4
Total: USD 88.00

1-Benzyl 4-(tert-butyl) 2-(hydroxymethyl)piperazine-1,4-dicarboxylate

  • CAS No. 317365-33-6

  • Cat. No. CS-0137188
  • Molecule weight350.41
  • Purity95+%
  • MDL No.MFCD11878465

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

1-Benzyl 4-(tert-butyl) 2-(hydroxymethyl)piperazine-1,4-dicarboxylate|CS-0137188

Structure of 317365-33-6

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General Information

  • CAS No. 317365-33-6
  • Cat. No. CS-0137188
  • Purity 95+%
  • MDL No. MFCD11878465
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₂₆N₂O₅
  • Molecular Weight 350.41
  • Synonym(s) 1-Benzyl 4-tert-butyl 2-(hydroxymethyl)piperazine-1,4-dicarboxylate
  • SMILES O=C(N1C(CO)CN(C(OC(C)(C)C)=O)CC1)OCC2=CC=CC=C2

Synthesis

  • Route1
    • tert-Butyl 3-oxotetrahydro-3H-oxazolo[3,4-a]pyrazine-7(1H)-carboxylate|CS-0128671
      935544-47-1
    • null|null
      501-53-1
    • ~86%
    • 1-Benzyl 4-(tert-butyl) 2-(hydroxymethyl)piperazine-1,4-dicarboxylate|CS-0137188
      317365-33-6

    References

    • Clark, Roger B.; Elbaum, Daniel Tetrahedron, 2007 , vol. 63, # 14 p. 3057 - 3065
  • Route2
    • In-stock
      Piperazine-2-carboxylic acid dihydrochloride|CS-W015473
      3022-15-9
    • null|null
      501-53-1
    • ~53%
    • 1-Benzyl 4-(tert-butyl) 2-(hydroxymethyl)piperazine-1,4-dicarboxylate|CS-0137188
      317365-33-6
    • null|null
      161894-56-0

    References

    • CRITICAL THERAPEUTICS, INC. Patent: WO2007/146066 A2, 2007 ; Location in patent: Page/Page column 192-193 ;
  • Route3

    References

    • CRITICAL THERAPEUTICS, INC. Patent: WO2007/146066 A2, 2007 ; Location in patent: Page/Page column 83 ;

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
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   79.31
  • LogP   2.2368
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   3

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