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CS-W001157 4
Total: USD 88.00

5-Iodo-1,3-dihydro-2H-benzo[d]imidazol-2-one

  • CAS No. 40644-14-2

  • Cat. No. CS-0608251
  • Purity≥98%
  • MDL No.MFCD05663527

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

5-Iodo-1,3-dihydro-2H-benzo[d]imidazol-2-one|CS-0608251

Structure of 40644-14-2

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General Information

  • CAS No. 40644-14-2
  • Cat. No. CS-0608251
  • Purity ≥98%
  • MDL No. MFCD05663527
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅IN₂O
  • Molecular Weight 260.03
  • Synonym(s) 5-Iodo-1,3-dihydro-benzimidazol-2-one
  • SMILES O=C1NC2=CC(I)=CC=C2N1

Synthesis

  • Route1
    • 1,3-Dihydro-2H-benzo[d]imidazol-2-one Rabeprazole Impurity|CS-0166731
      615-16-7
    • ~90%
    • 5-Iodo-1,3-dihydro-2H-benzo[d]imidazol-2-one|CS-0608251
      40644-14-2

    References

    • Emmanuvel, Lourdusamy; Shukla, Ravi Kant; Sudalai, Arumugam; Gurunath, Suryavanshi; Sivaram, Swaminathan Tetrahedron Letters, 2006 , vol. 47, # 28 p. 4793 - 4796
  • Route2

    References

    • Pfizer Inc Patent: US6166011 A1, 2000 ;
  • Route3
    • 5-Iodo-2-nitroaniline|CS-0872516
      20289-35-4
    • ~%
    • 5-Iodo-1,3-dihydro-2H-benzo[d]imidazol-2-one|CS-0608251
      40644-14-2

    References

    • Feitelson et al. Journal of the Chemical Society, 1952 , p. 2389,2393

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   48.65
  • LogP   1.4608
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   0

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