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CS-W001157 4
Total: USD 88.00

3-Iodo-4-methylbenzamide

  • CAS No. 269411-70-3

  • Cat. No. CS-0323824
  • Purity≥98%
  • MDL No.None

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

3-Iodo-4-methylbenzamide|CS-0323824

Structure of 269411-70-3

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General Information

  • CAS No. 269411-70-3
  • Cat. No. CS-0323824
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈INO
  • Molecular Weight 261.06
  • Synonym(s) Benzamide,3-iodo-4-methyl
  • SMILES CC1=C(I)C=C(C(N)=O)C=C1

Synthesis

  • Route1

    References

    • Agouron Pharmaceuticals, Inc. Patent: US6369226 B1, 2002 ; Location in patent: Page column 12 ; US 6369226 B1
  • Route2
    • null|null
      52107-98-9
    • ~%
    • 3-Iodo-4-methylbenzamide|CS-0323824
      269411-70-3

    References

    • Reich, Siegfried H.; Johnson, Theodore; Wallace, Michael B.; Kephart, Susan E.; Fuhrman, Shella A.; Worland, Stephen T.; Matthews, David A.; Hendrickson, Thomas F.; Chan, Fora; Meador III, James; Ferre, Rose Ann; Brown, Edward L.; DeLisle, Dorothy M.; Patick, Amy K.; Binford, Susan L.; Ford, Clifford E. Journal of Medicinal Chemistry, 2000 , vol. 43, # 9 p. 1670 - 1683

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

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Computational Chemistry Data

  • TPSA   43.09
  • LogP   1.69852
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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