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CS-W001157 4
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trans-4-((2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)methyl)cyclohexanecarboxylic acid

  • CAS No. 69907-67-1

  • Cat. No. CS-W006952
  • Purity≥97%
  • MDL No.MFCD11519178

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

trans-4-((2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)methyl)cyclohexanecarboxylic acid|CS-W006952

Structure of 69907-67-1

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General Information

  • CAS No. 69907-67-1
  • Cat. No. CS-W006952
  • Purity ≥97%
  • MDL No. MFCD11519178
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₅NO₄
  • Molecular Weight 237.25
  • Synonym(s) trans-4-[(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)methyl]cyclohexanecarboxylic Acid
  • SMILES O=C([C@H]1CC[C@H](CN2C(C=CC2=O)=O)CC1)O

Description

trans-4-((2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)methyl)cyclohexanecarboxylic acid features a rigid trans-cyclohexane scaffold bearing a pyrrole-derived acyl group. This configuration imparts enhanced stability and defined spatial orientation, enabling precise molecular positioning in conjugation chemistries. The molecule integrates readily into bioconjugation workflows where controlled presentation of functional groups is critical.

Synthesis

  • Route1
    • null|null
      69907-68-2
    • ~%
    • In-stock
      trans-4-((2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)methyl)cyclohexanecarboxylic acid|CS-W006952
      69907-67-1

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 17, # 13 p. 3749 - 3753
  • Route2
    • trans-4-(Aminomethyl)cyclohexanecarboxylic acid|CS-0655397
      1197-18-8
    • ~%
    • In-stock
      trans-4-((2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)methyl)cyclohexanecarboxylic acid|CS-W006952
      69907-67-1

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 17, # 13 p. 3749 - 3753
  • Route3
    • null|null
      108-31-6
    • trans-4-(Aminomethyl)cyclohexanecarboxylic acid|CS-0655397
      1197-18-8
    • ~%
    • In-stock
      trans-4-((2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)methyl)cyclohexanecarboxylic acid|CS-W006952
      69907-67-1

    References

    • Organic Preparations and Procedures International, , vol. 25, # 5 p. 592 - 594

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

Quality Control

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Computational Chemistry Data

  • TPSA   74.68
  • LogP   0.8024
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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