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CS-W001157 4
Total: USD 88.00

6-(Trifluoromethyl)-1H-benzo[d]imidazol-2-amine

  • CAS No. 10057-46-2

  • Cat. No. CS-0120140
  • Purity≥97%
  • MDL No.MFCD16660394

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

6-(Trifluoromethyl)-1H-benzo[d]imidazol-2-amine|CS-0120140

Structure of 10057-46-2

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General Information

  • CAS No. 10057-46-2
  • Cat. No. CS-0120140
  • Purity ≥97%
  • MDL No. MFCD16660394
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆F₃N₃
  • Molecular Weight 201.15
  • Synonym(s) None
  • SMILES NC1=NC2=CC=C(C(F)(F)F)C=C2N1

Description

6-(Trifluoromethyl)-1H-benzo[d]imidazol-2-amine features a trifluoromethyl group at the 6-position, enhancing electron-withdrawal and metabolic stability. This bench-stable heterocycle integrates readily into pharmaceutical scaffolds, offering improved solubility and bioavailability in target-directed drug discovery.

Application

6-(Trifluoromethyl)-1H-benzo[d]imidazol-2-amine serves as a versatile heterocyclic building block in medicinal chemistry, enabling the construction of bioactive scaffolds through standard coupling and functionalization reactions. Its trifluoromethyl group enhances metabolic stability and lipophilicity, while the imidazole nitrogen supports hydrogen bonding and coordination in target interactions. The compound exhibits bench stability and compatibility with common synthetic protocols, facilitating purification and integration into multi-step syntheses.

Synthesis

  • Route1
    • null|null
      506-68-3
    • In-stock
      4-(Trifluoromethyl)benzene-1,2-diamine|CS-W007576
      368-71-8
    • ~86%
    • In-stock
      6-(Trifluoromethyl)-1H-benzo[d]imidazol-2-amine|CS-0120140
      10057-46-2

    References

    • MERCK PATENT GMBH Patent: WO2005/4864 A1, 2005 ; Location in patent: Page/Page column 122-123 ; WO 2005/004864 A1
  • Route2

    References

    • US4018790 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-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   54.7
  • LogP   2.1639
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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