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CS-W001157 4
Total: USD 88.00

TRANS-2-(4-AMINOCYCLOHEXYL)ACETIC ACID HCL

  • CAS No. 76325-96-7

  • Cat. No. CS-0039017
  • Purity≥97%
  • MDL No.None

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

TRANS-2-(4-AMINOCYCLOHEXYL)ACETIC ACID HCL|CS-0039017

Structure of 76325-96-7

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General Information

  • CAS No. 76325-96-7
  • Cat. No. CS-0039017
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₆ClNO₂
  • Molecular Weight 193.67
  • Synonym(s) trans-2-(4-Aminocyclohexyl)acetic acid hydrochloride
  • SMILES C1C[C@@H](CC[C@H]1CC(=O)O)N.Cl

Synthesis

  • Route1
    • trans-4-Aminocyclohexylacetic acid|CS-0271206
      2952-00-3
    • ~%
    • TRANS-2-(4-AMINOCYCLOHEXYL)ACETIC ACID HCL|CS-0039017
      76325-96-7

    References

    • Gobbi, Luca; Jaeschke, Georg; Rodriguez Sarmiento, Rosa Maria; Steward, Lucinda Patent: US2009/42943 A1, 2009 ; Location in patent: Page/Page column 10 ; US 20090042943 A1
  • Route2
    • cis-4-Aminocyclohexaneacetic acid|CS-0661953
      2952-01-4
    • ~70%
    • TRANS-2-(4-AMINOCYCLOHEXYL)ACETIC ACID HCL|CS-0039017
      76325-96-7

    References

    • Karpavichyus, K. I.; Palaima, A. I.; Knunyants, I. L. Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), 1980 , vol. 29, p. 1689 - 1694 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1980 , # 10 p. 2374 - 2379
  • Route3
    • 4-Nitrobenzeneacetic acid Indobufen  Impurity|CS-0229459
      104-03-0
    • ~%
    • cis-2-(4-aminocyclohexyl)acetic acid hydrochloride|CS-0476419
      61367-39-3
    • TRANS-2-(4-AMINOCYCLOHEXYL)ACETIC ACID HCL|CS-0039017
      76325-96-7

    References

    • Karpavichyus, K. I.; Palaima, A. I.; Knunyants, I. L. Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), 1980 , vol. 29, p. 1689 - 1694 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1980 , # 10 p. 2374 - 2379

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   63.32
  • LogP   1.4004
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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