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CS-W001157 4
Total: USD 88.00

2,3,5,6-tetrahydro-1H-imidazo[1,2-a]imidazole

  • CAS No. 6573-15-5

  • Cat. No. CS-0179169
  • Purity≥98%
  • MDL No.None

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

2,3,5,6-tetrahydro-1H-imidazo[1,2-a]imidazole|CS-0179169

Structure of 6573-15-5

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General Information

  • CAS No. 6573-15-5
  • Cat. No. CS-0179169
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₉N₃
  • Molecular Weight 111.15
  • Synonym(s) 1,4,6-Triazabicyclo[3.3.0]oct-4-ene
  • SMILES N1=C2NCCN2CC1

Synthesis

  • Route1
    • null|null
      111-40-0
    • null|null
      693-13-0
    • ~71%
    • 2,3,5,6-tetrahydro-1H-imidazo[1,2-a]imidazole|CS-0179169
      6573-15-5

    References

    • Shen, Hao; Wang, Yang; Xie, Zuowei Organic Letters, 2011 , vol. 13, # 17 p. 4562 - 4565
  • Route2

    References

    • Shen, Hao; Wang, Yang; Xie, Zuowei Organic Letters, 2011 , vol. 13, # 17 p. 4562 - 4565
  • Route3
    • null|null
      75-15-0
    • null|null
      111-40-0
    • ~39%
    • 2,3,5,6-tetrahydro-1H-imidazo[1,2-a]imidazole|CS-0179169
      6573-15-5

    References

    • Hedrick, James Lupton; Pratt, Russell Clayton; Waymouth, Robert M. Patent: US2011/4014 A1, 2011 ; Location in patent: Page/Page column 10 ;

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   27.63
  • LogP   -0.7388
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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