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CS-W001157 4
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Methyl 2-(2-methyl-5-nitrophenyl)acetate

  • CAS No. 287119-84-0

  • Cat. No. CS-0450481
  • Purity≥98%
  • MDL No.None

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

Methyl 2-(2-methyl-5-nitrophenyl)acetate|CS-0450481

Structure of 287119-84-0

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General Information

  • CAS No. 287119-84-0
  • Cat. No. CS-0450481
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁NO₄
  • Molecular Weight 209.20
  • Synonym(s) Benzeneacetic acid, 2-Methyl-5-nitro-, Methyl ester
  • SMILES CC1=CC=C(C=C1CC(=O)OC)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Sykes, Bridget M.; Hay, Michael P.; Bohinc-Herceg, Dubravka; Helsby, Nuala A.; O'Connor, Charmian J.; Denny, William A. Journal of the Chemical Society, Perkin Transactions 1, 2000 , # 10 p. 1601 - 1608
  • Route2

    References

    • Sykes, Bridget M.; Hay, Michael P.; Bohinc-Herceg, Dubravka; Helsby, Nuala A.; O'Connor, Charmian J.; Denny, William A. Journal of the Chemical Society, Perkin Transactions 1, 2000 , # 10 p. 1601 - 1608

Safety Information

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Hazard Statements : N/A
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Computational Chemistry Data

  • TPSA   69.44
  • LogP   1.61872
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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