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CS-W001157 4
Total: USD 88.00

Methyl 3-nitro-5-methylgentisate

  • CAS No. 2888-09-7

  • Cat. No. CS-0033831
  • Purity≥98%
  • MDL No.MFCD16140302

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

Methyl 3-nitro-5-methylgentisate|CS-0033831

Structure of 2888-09-7

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General Information

  • CAS No. 2888-09-7
  • Cat. No. CS-0033831
  • Purity ≥98%
  • MDL No. MFCD16140302
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO₆
  • Molecular Weight 227.17
  • Synonym(s) Methyl 2-hydroxy-5-methoxy-3-nitrobenzoate
  • SMILES O=C(OC)C1=CC(OC)=CC([N+]([O-])=O)=C1O

Synthesis

  • Route1

    References

    • Yan, Yan; Qin, Bo; Ren, Changliang; Yip, Yeow Kwan; Ye, Ruijuan; Zeng, Huaqiang; Chen, Xiuying; Su, Haibin; Zhang, Dawei Journal of the American Chemical Society, 2010 , vol. 132, # 16 p. 5869 - 5879
  • Route2
    • In-stock
      Methyl 2-hydroxy-5-methoxybenzoate|CS-W002115
      2905-82-0
    • null|null
      7697-37-2
    • null|null
      64-19-7
    • ~%
    • Methyl 3-nitro-5-methylgentisate|CS-0033831
      2888-09-7

    References

    • Monatshefte fuer Chemie, , vol. 33, p. 1247

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   98.9
  • LogP   1.0956
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   3

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