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CS-W001157 4
Total: USD 88.00

2-Butoxy-4-fluoro-1-nitrobenzene

  • CAS No. 28987-47-5

  • Cat. No. CS-0208955
  • Molecule weight213.21
  • Purity≥96%
  • MDL No.MFCD19684088

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

2-Butoxy-4-fluoro-1-nitrobenzene|CS-0208955

Structure of 28987-47-5

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General Information

  • CAS No. 28987-47-5
  • Cat. No. CS-0208955
  • Purity ≥96%
  • MDL No. MFCD19684088
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂FNO₃
  • Molecular Weight 213.21
  • Synonym(s) 3-Fluoro-6-nitrophenyl-n-butylether
  • SMILES CCCCOC1=C(C=CC(=C1)F)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Han, Young Taek; Kim, Kyeojin; Choi, Gyeong-In; An, Hongchan; Son, Dohyun; Kim, Hee; Ha, Hee-Jin; Son, Jun-Hyeng; Chung, Suk-Jae; Park, Hyun-Ju; Lee, Jeewoo; Suh, Young-Ger European Journal of Medicinal Chemistry, 2014 , vol. 79, p. 128 - 142

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.37
  • LogP   2.9128
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   5

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