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CS-W001157 4
Total: USD 88.00

3-Methyl-5-nitrobenzonitrile

  • CAS No. 124289-22-1

  • Cat. No. CS-W003891
  • Purity≥95%
  • MDL No.MFCD17170423

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

3-Methyl-5-nitrobenzonitrile|CS-W003891

Structure of 124289-22-1

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General Information

  • CAS No. 124289-22-1
  • Cat. No. CS-W003891
  • Purity ≥95%
  • MDL No. MFCD17170423
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆N₂O₂
  • Molecular Weight 162.15
  • Synonym(s) None
  • SMILES N#Cc1cc(C)cc(c1)[N+](=O)[O-]

Synthesis

  • Route1
    • In-stock
      1-Bromo-3-methyl-5-nitrobenzene|CS-0153266
      52488-28-5
    • null|null
      544-92-3
    • ~60%
    • In-stock
      3-Methyl-5-nitrobenzonitrile|CS-W003891
      124289-22-1

    References

    • Adams; Rinehart Journal of Antibiotics, 1994 , vol. 47, # 12 p. 1456 - 1465
  • Route2

    References

    • Journal of Antibiotics, , vol. 47, # 12 p. 1456 - 1465
  • Route3
    • null|null
      89-62-3
    • ~%
    • In-stock
      3-Methyl-5-nitrobenzonitrile|CS-W003891
      124289-22-1

    References

    • Journal of Antibiotics, , vol. 47, # 12 p. 1456 - 1465

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

Quality Control

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Computational Chemistry Data

  • TPSA   66.93
  • LogP   1.7749
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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