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CS-W001157 4
Total: USD 88.00

Ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate

  • CAS No. 3543-72-4

  • Cat. No. CS-0151583
  • Molecule weight291.31
  • Purity≥98%
  • MDL No.MFCD09840985

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

Ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate|CS-0151583

Structure of 3543-72-4

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General Information

  • CAS No. 3543-72-4
  • Cat. No. CS-0151583
  • Purity ≥98%
  • MDL No. MFCD09840985
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₇N₃O₄
  • Molecular Weight 291.31
  • Synonym(s) 1-Methyl-5-nitro-1H-benzimidazole-2-butanoic acid ethyl ester
  • SMILES CCOC(=O)CCCC1=NC2=C(C=CC(=C2)[N+](=O)[O-])N1C

Synthesis

  • Route1
    • null|null
      64-17-5
    • 4-(1-Methyl-5-Nitro-1H-benzoimidazol-2-yl)-butyric acid|CS-0760632
      31349-48-1
    • ~93%
    • In-stock
      Ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate|CS-0151583
      3543-72-4

    References

    • Heyl Chemisch-pharmazeutische Fabrik GmbH and Co. KG; Frey, Michael; Walther, Dirk-Detlef Patent: US2014/31560 A1, 2014 ; Location in patent: Paragraph 0101; 0102 ;
  • Route2

    References

    • US2014/31560 A1, ;
  • Route3
    • null|null
      108-55-4
    • ~%
    • In-stock
      Ethyl 4-(1-methyl-5-nitro-1H-benzo[d]imidazol-2-yl)butanoate|CS-0151583
      3543-72-4

    References

    • US2014/31560 A1, ;

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   87.26
  • LogP   2.3673
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   6

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