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CS-W001157 4
Total: USD 88.00

2-Methyl-3-nitrophenylacetic acid

  • CAS No. 23876-15-5

  • Cat. No. CS-W003436
  • Purity≥98%
  • MDL No.MFCD07782132

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

2-Methyl-3-nitrophenylacetic acid|CS-W003436

Structure of 23876-15-5

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General Information

  • CAS No. 23876-15-5
  • Cat. No. CS-W003436
  • Purity ≥98%
  • MDL No. MFCD07782132
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO₄
  • Molecular Weight 195.17
  • Synonym(s) 2-Methyl-3-NitrophenylAceticAcid
  • SMILES OC(=O)Cc1cccc(c1C)[N+](=O)[O-]

Synthesis

  • Route1
    • 2-(2-Methyl-3-nitrophenyl)acetonitrile|CS-0308497
      23876-14-4
    • ~98%
    • In-stock
      2-Methyl-3-nitrophenylacetic acid|CS-W003436
      23876-15-5

    References

    • Gallagher, Gregory; Lavanchy, Patricia G.; Wilson, James W.; Hieble, J. Paul; DeMarinis, Robert M. Journal of Medicinal Chemistry, 1985 , vol. 28, # 10 p. 1533 - 1536
  • Route2

    References

    • Journal of Medicinal Chemistry, , vol. 28, # 10 p. 1533 - 1536
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 28, # 10 p. 1533 - 1536

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   80.44
  • LogP   1.53032
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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