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CS-W001157 4
Total: USD 88.00

3-Methyl-4-nitrobenzamide

  • CAS No. 99584-85-7

  • Cat. No. CS-0316770
  • Purity≥97%
  • MDL No.None

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

3-Methyl-4-nitrobenzamide|CS-0316770

Structure of 99584-85-7

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General Information

  • CAS No. 99584-85-7
  • Cat. No. CS-0316770
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈N₂O₃
  • Molecular Weight 180.16
  • Synonym(s) 4-Nitro-m-toluamide
  • SMILES CC1=CC(=CC=C1[N+](=O)[O-])C(=O)N

Synthesis

  • Route1
    • null|null
      35675-46-8
    • ~%
    • 3-Methyl-4-nitrobenzamide|CS-0316770
      99584-85-7

    References

    • WO2008/88927 A1, ; Page/Page column 26-27 ; WO 2008/088927 A1
  • Route2

    References

    • Justus Liebigs Annalen der Chemie, , vol. 144, p. 182

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   86.23
  • LogP   1.00212
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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