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CS-W001157 4
Total: USD 88.00

2-Acetamido-3-methyl-5-nitrobenzoic acid

  • CAS No. 95541-19-8

  • Cat. No. CS-0335884
  • Molecule weight238.20
  • Purity≥98%
  • MDL No.None

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

2-Acetamido-3-methyl-5-nitrobenzoic acid|CS-0335884

Structure of 95541-19-8

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General Information

  • CAS No. 95541-19-8
  • Cat. No. CS-0335884
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀N₂O₅
  • Molecular Weight 238.20
  • Synonym(s) 2-(ACETYLAMINO)-3-METHYL-5-NITROBENZOIC ACID
  • SMILES CC1=CC([N+]([O-])=O)=CC(C(O)=O)=C1NC(C)=O

Synthesis

  • Route1
    • 2-Acetamido-3-methylbenzoic acid|CS-0731871
      67081-69-0
    • ~99%
    • 2-Acetamido-3-methyl-5-nitrobenzoic acid|CS-0335884
      95541-19-8

    References

    • Montoya-Pelaez, Pedro J.; Uh, Yoon-Seo; Lata, Christopher; Thompson, Matthew P.; Lemieux, Robert P.; Crudden, Cathleen M. Journal of Organic Chemistry, 2006 , vol. 71, # 16 p. 5921 - 5929
  • Route2
    • null|null
      5437-38-7
    • ~%
    • 2-Acetamido-3-methyl-5-nitrobenzoic acid|CS-0335884
      95541-19-8

    References

    • Montoya-Pelaez, Pedro J.; Uh, Yoon-Seo; Lata, Christopher; Thompson, Matthew P.; Lemieux, Robert P.; Crudden, Cathleen M. Journal of Organic Chemistry, 2006 , vol. 71, # 16 p. 5921 - 5929
  • Route3

    References

    • Montoya-Pelaez, Pedro J.; Uh, Yoon-Seo; Lata, Christopher; Thompson, Matthew P.; Lemieux, Robert P.; Crudden, Cathleen M. Journal of Organic Chemistry, 2006 , vol. 71, # 16 p. 5921 - 5929

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   109.54
  • LogP   1.55982
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   3

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