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CS-W001157 4
Total: USD 88.00

2-(5-Fluoro-2-nitrophenyl)acetonitrile

  • CAS No. 3456-75-5

  • Cat. No. CS-0314088
  • Molecule weight180.14
  • Purity≥98%
  • MDL No.None

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

2-(5-Fluoro-2-nitrophenyl)acetonitrile|CS-0314088

Structure of 3456-75-5

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General Information

  • CAS No. 3456-75-5
  • Cat. No. CS-0314088
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅FN₂O₂
  • Molecular Weight 180.14
  • Synonym(s) 5-Fluoro-2-nitrophenylacetonitrile
  • SMILES C1=C(C=C(CC#N)C(=C1)[N+](=O)[O-])F

Synthesis

  • Route1

    References

    • Makosza, Mieczyslaw; Wenaell, Maria; Golinski, Miroslaw; Kinowski, Andrzej Bulletin of the Polish Academy of Sciences, Chemistry, 1985 , vol. 33, # 9-10 p. 427 - 432
  • Route2
    • null|null
      352-70-5
    • ~%
    • 2-(5-Fluoro-2-nitrophenyl)acetonitrile|CS-0314088
      3456-75-5

    References

    • Journal of Heterocyclic Chemistry, , vol. 2, p. 298 - 299
  • Route3
    • null|null
      456-41-7
    • ~%
    • 2-(5-Fluoro-2-nitrophenyl)acetonitrile|CS-0314088
      3456-75-5

    References

    • Journal of Heterocyclic Chemistry, , vol. 2, p. 298 - 299

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302-H312-H315-H319-H331-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   66.93
  • LogP   1.79998
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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