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CS-W001157 4
Total: USD 88.00

1-Methyl-6-nitro-1H-benzimidazole

  • CAS No. 5381-79-3

  • Cat. No. CS-0204792
  • Purity≥97%
  • MDL No.MFCD00962814

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

1-Methyl-6-nitro-1H-benzimidazole|CS-0204792

Structure of 5381-79-3

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General Information

  • CAS No. 5381-79-3
  • Cat. No. CS-0204792
  • Purity ≥97%
  • MDL No. MFCD00962814
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇N₃O₂
  • Molecular Weight 177.16
  • Synonym(s) 1-Methyl-6-nitrobenzimidazole
  • SMILES O=N(=O)C=1C=CC=2N=CN(C2C1)C

Synthesis

  • Route1
    • null|null
      74-88-4
    • ~%
    • In-stock
      1-Methyl-6-nitro-1H-benzimidazole|CS-0204792
      5381-79-3
    • 1-Methyl-5-nitro-1H-benzo[d]imidazole|CS-0314716
      5381-78-2

    References

    • F2G LTD Patent: WO2006/123145 A1, 2006 ; Location in patent: Page/Page column 53 ;
  • Route2
    • In-stock
      5-Nitrobenzimidazole|CS-W010848
      94-52-0
    • null|null
      74-88-4
    • ~%
    • In-stock
      1-Methyl-6-nitro-1H-benzimidazole|CS-0204792
      5381-79-3
    • 1-Methyl-5-nitro-1H-benzo[d]imidazole|CS-0314716
      5381-78-2

    References

    • Lee, Jeewoo; Tran, Phuong-Thao; Hoang, Van-Hai; Thorat, Shivaji A.; Kim, Sung Eun; Ann, Jihyae; Chang, Yu Jin; Nam, Dong Woo; Song, Hyundong; Mook-Jung, Inhee; Lee, Jiyoun Bioorganic and Medicinal Chemistry, 2013 , vol. 21, # 13 p. 3821 - 3830
  • Route3
    • null|null
      50-00-0
    • null|null
      99-56-9
    • ~40%
    • In-stock
      1-Methyl-6-nitro-1H-benzimidazole|CS-0204792
      5381-79-3

    References

    • Lopez-Alvarado, Pilar; Avendano, Carmen; Menendez, J. Carlos Heterocycles, 1991 , vol. 32, # 5 p. 1003 - 1012

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   60.96
  • LogP   1.4815
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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