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CS-W001157 4
Total: USD 88.00

Methyl 5-bromo-2-methoxy-3-nitrobenzoate

  • CAS No. 67657-90-3

  • Cat. No. CS-0077557
  • Purity95+%
  • MDL No.MFCD21340336

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

Methyl 5-bromo-2-methoxy-3-nitrobenzoate|CS-0077557

Structure of 67657-90-3

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General Information

  • CAS No. 67657-90-3
  • Cat. No. CS-0077557
  • Purity 95+%
  • MDL No. MFCD21340336
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈BrNO₅
  • Molecular Weight 290.07
  • Synonym(s) None
  • SMILES COC1=C(C(OC)=O)C=C(Br)C=C1[N+]([O-])=O

Synthesis

  • Route1
    • 5-Bromo-2-methoxy-3-nitrobenzoic acid|CS-0465959
      60541-89-1
    • null|null
      77-78-1
    • ~87%
    • Methyl 5-bromo-2-methoxy-3-nitrobenzoate|CS-0077557
      67657-90-3

    References

    • Shao, Teng; Wang, Juan; Chen, Jian-Gang; Wang, Xiao-Meng; Li, Huan; Li, Yi-Ping; Li, Yan; Yang, Guang-De; Mei, Qi-Bing; Zhang, San-Qi European Journal of Medicinal Chemistry, 2014 , vol. 75, p. 96 - 105
  • Route2
    • 5-Bromo-2-methoxy-3-nitrobenzoic acid|CS-0465959
      60541-89-1
    • null|null
      74-88-4
    • ~78%
    • Methyl 5-bromo-2-methoxy-3-nitrobenzoate|CS-0077557
      67657-90-3

    References

    • Baruah, Pranjal K.; Sreedevi; Gonnade, Rajesh; Ravindranathan, Sapna; Damodaran, Krishnan; Hofmann, Hans-Joerg; Sanjayan, Gangadhar J. Journal of Organic Chemistry, 2007 , vol. 72, # 2 p. 636 - 639
  • Route3

    References

    • Baruah, Pranjal K.; Sreedevi; Gonnade, Rajesh; Ravindranathan, Sapna; Damodaran, Krishnan; Hofmann, Hans-Joerg; Sanjayan, Gangadhar J. Journal of Organic Chemistry, 2007 , vol. 72, # 2 p. 636 - 639

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   78.67
  • LogP   2.1525
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   3

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