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CS-W001157 4
Total: USD 88.00

1H-benzo[d]imidazole-6-carbohydrazide

  • CAS No. 108038-52-4

  • Cat. No. CS-0316687
  • Molecule weight176.18
  • Purity≥97%
  • MDL No.None

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

1H-benzo[d]imidazole-6-carbohydrazide|CS-0316687

Structure of 108038-52-4

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General Information

  • CAS No. 108038-52-4
  • Cat. No. CS-0316687
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈N₄O
  • Molecular Weight 176.18
  • Synonym(s) 5-Benzimidazolecarboxylicacid,hydrazide(6CI)
  • SMILES NNC(C1=CC=2NC=NC2C=C1)=O

Synthesis

  • Route1
    • Ethyl 1H-benzimidazole-5-carboxylate|CS-0071748
      58842-61-8
    • ~92%
    • 1H-benzo[d]imidazole-6-carbohydrazide|CS-0316687
      108038-52-4

    References

    • Cong, Chao; Wang, Haiyang; Hu, Yue; Liu, Chen; Ma, Siti; Li, Xin; Cao, Jichao; Ma, Shutao European Journal of Medicinal Chemistry, 2011 , vol. 46, # 7 p. 3105 - 3111
  • Route2

    References

    • Ramsbeck, Daniel; Buchholz, Mirko; Koch, Birgit; Boehme, Livia; Hoffmann, Torsten; Demuth, Hans-Ulrich; Heiser, Ulrich Journal of Medicinal Chemistry, 2013 , vol. 56, # 17 p. 6613 - 6625
  • Route3

    References

    • Cong, Chao; Wang, Haiyang; Hu, Yue; Liu, Chen; Ma, Siti; Li, Xin; Cao, Jichao; Ma, Shutao European Journal of Medicinal Chemistry, 2011 , vol. 46, # 7 p. 3105 - 3111

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   83.8
  • LogP   0.1664
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   1

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