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CS-W001157 4
Total: USD 88.00

1-Bromo-4-methoxy-2-methyl-3-nitrobenzene

  • CAS No. 85598-13-6

  • Cat. No. CS-0210855
  • Purity≥98%
  • MDL No.MFCD18452104

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

1-Bromo-4-methoxy-2-methyl-3-nitrobenzene|CS-0210855

Structure of 85598-13-6

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General Information

  • CAS No. 85598-13-6
  • Cat. No. CS-0210855
  • Purity ≥98%
  • MDL No. MFCD18452104
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈BrNO₃
  • Molecular Weight 246.06
  • Synonym(s) 4-bromo-3-methyl-2-nitrophenyl methyl ether
  • SMILES CC1=C(C(=CC=C1Br)OC)[N+](=O)[O-]

Synthesis

  • Route1
    • In-stock
      4-Bromo-3-methyl-2-nitrophenol|CS-0050984
      85598-12-5
    • null|null
      74-88-4
    • ~99%
    • In-stock
      1-Bromo-4-methoxy-2-methyl-3-nitrobenzene|CS-0210855
      85598-13-6

    References

    • Yang, Cai-Guang; Wang, Jun; Jiang, Biao Tetrahedron Letters, 2002 , vol. 43, # 6 p. 1063 - 1066
  • Route2

    References

    • WYETH Patent: WO2009/111260 A1, 2009 ; Location in patent: Page/Page column 35 ; WO 2009/111260 A1
  • Route3

    References

    • Yang, Cai-Guang; Wang, Jun; Jiang, Biao Tetrahedron Letters, 2002 , vol. 43, # 6 p. 1063 - 1066

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
Precautionary Statements : P264-P270-P330-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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