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CS-W001157 4
Total: USD 88.00

2-(Benzyloxy)-4-fluoro-1-nitrobenzene

  • CAS No. 129464-01-3

  • Cat. No. CS-0444459
  • Purity≥98%
  • MDL No.None

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

2-(Benzyloxy)-4-fluoro-1-nitrobenzene|CS-0444459

Structure of 129464-01-3

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General Information

  • CAS No. 129464-01-3
  • Cat. No. CS-0444459
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₀FNO₃
  • Molecular Weight 247.22
  • Synonym(s) 4-fluoro-1-nitro-2-phenylmethoxybenzene
  • SMILES C1=CC=C(C=C1)COC2=C(C=CC(=C2)F)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Takeda Pharmaceutical Company Limited Patent: EP2371826 A1, 2011 ; Location in patent: Page/Page column 46 ;
  • Route2

    References

    • E. I. du Pont de Nemours and Company Patent: US5750471 A1, 1998 ;
  • Route3

    References

    • Park, Chi Hoon; Choe, Hyeonjeong; Jang, In-Young; Kwon, So Yeong; Latif, Muhammad; Lee, Heung Kyoung; Lee, Hyeon Ji; Yang, Eun Hye; Yun, Jeong In; Chae, Chong Hak; Cho, Sung Yun; Choi, Sang Un; Ha, Jae Du; Jung, Heejung; Kim, Hyoung Rae; Kim, Pilho; Lee, Chong Ock; Yun, Chang-Soo; Lee, Kwangho Bioorganic and Medicinal Chemistry Letters, 2013 , vol. 23, # 22 p. 6192 - 6196

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

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Computational Chemistry Data

  • TPSA   52.37
  • LogP   3.3129
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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