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CS-W001157 4
Total: USD 88.00

1-Bromo-2-methoxy-4-methyl-5-nitrobenzene

  • CAS No. 861076-28-0

  • Cat. No. CS-0052591
  • Purity≥97%
  • MDL No.MFCD11007872

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

1-Bromo-2-methoxy-4-methyl-5-nitrobenzene|CS-0052591

Structure of 861076-28-0

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General Information

  • CAS No. 861076-28-0
  • Cat. No. CS-0052591
  • Purity ≥97%
  • MDL No. MFCD11007872
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈BrNO₃
  • Molecular Weight 246.06
  • Synonym(s) 2-BROMO-5-METHYL-4-NITROANISOLE
  • SMILES COC1=CC(C)=C(C=C1Br)[N+]([O-])=O

Synthesis

  • Route1
    • In-stock
      3-Methyl-4-nitrophenol|CS-W023077
      2581-34-2
    • null|null
      74-88-4
    • ~%
    • 2-Bromo-1-methoxy-3-methyl-4-nitrobenzene|CS-0754209
      1196875-90-7
    • In-stock
      1-Bromo-2-methoxy-4-methyl-5-nitrobenzene|CS-0052591
      861076-28-0

    References

    • TAKEDA SAN DIEGO, INC. Patent: US2009/286800 A1, 2009 ; Location in patent: Page/Page column 109-111 ; US 20090286800 A1
  • Route2

    References

    • Kermack; Wight Journal of the Chemical Society, 1935 , p. 1425
  • Route3
    • In-stock
      2-Bromo-5-methyl-4-nitrophenol|CS-0613150
      14401-60-6
    • null|null
      77-78-1
    • ~%
    • In-stock
      1-Bromo-2-methoxy-4-methyl-5-nitrobenzene|CS-0052591
      861076-28-0

    References

    • Kermack; Wight Journal of the Chemical Society, 1935 , p. 1425

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

Quality Control

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Computational Chemistry Data

  • TPSA   52.37
  • LogP   2.67432
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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