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CS-W001157 4
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1-(Benzyloxy)-2-bromo-4-nitrobenzene

  • CAS No. 191602-86-5

  • Cat. No. CS-0215612
  • Molecule weight308.13
  • Purity≥95%
  • MDL No.None

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

1-(Benzyloxy)-2-bromo-4-nitrobenzene|CS-0215612

Structure of 191602-86-5

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General Information

  • CAS No. 191602-86-5
  • Cat. No. CS-0215612
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₀BrNO₃
  • Molecular Weight 308.13
  • Synonym(s) benzyl-(2-bromo-4-nitro-phenyl)-ether
  • SMILES C1=CC=C(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])Br

Synthesis

  • Route1

    References

    • Dawson, Marcia I.; Xia, Zebin; Jiang, Tao; Ye, Mao; Fontana, Joseph A.; Farhana, Lulu; Patel, Bhaumik; Li, Ping Xue; Bhuiyan, Mohammad; Pellicciari, Roberto; Macchiarulo, Antonio; Nuti, Roberto; Zhang, Xiao-Kun; Han, Young-Hoon; Tautz, Lutz; Hobbs, Peter D.; Jong, Ling; Waleh, Nahid; Chao, Wan-Ru; Feng, Gen-Sheng; Pang, Yuhong; Su, Ying Journal of Medicinal Chemistry, 2008 , vol. 51, # 18 p. 5650 - 5662
  • Route2
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    • ~%
    • 1-(Benzyloxy)-2-bromo-4-nitrobenzene|CS-0215612
      191602-86-5

    References

    • Roll; Hoelz Journal fuer Praktische Chemie (Leipzig), 1885 , vol. <2> 32, p. 57

Safety Information

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GHS Pictogram : N/A
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Signal Word : N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   52.37
  • LogP   3.9363
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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