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CS-W001157 4
Total: USD 88.00

1-Methyl-1,4-diazepan-5-one

  • CAS No. 5441-40-7

  • Cat. No. CS-W003571
  • Purity≥97%
  • MDL No.MFCD09027949

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

1-Methyl-1,4-diazepan-5-one|CS-W003571

Structure of 5441-40-7

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General Information

  • CAS No. 5441-40-7
  • Cat. No. CS-W003571
  • Purity ≥97%
  • MDL No. MFCD09027949
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₂N₂O
  • Molecular Weight 128.17
  • Synonym(s) 5H-1,4-Diazepin-5-one, hexahydro-1-methyl-
  • SMILES CN1CCNC(=O)CC1

Synthesis

  • Route1
    • 1-Methylpiperidin-4-one oxime|CS-0205971
      1515-27-1
    • ~%
    • In-stock
      1-Methyl-1,4-diazepan-5-one|CS-W003571
      5441-40-7

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 11, # 19 p. 2651 - 2653
  • Route2
    • null|null
      1445-73-4
    • ~%
    • In-stock
      1-Methyl-1,4-diazepan-5-one|CS-W003571
      5441-40-7

    References

    • Journal of Organic Chemistry, , vol. 14, p. 530,534 Journal of Scientific and Industrial Research, , vol. 17 B, p. 31

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   32.34
  • LogP   -0.5619
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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