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CS-W001157 4
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2-(Bromomethyl)-3-fluorobenzonitrile

  • CAS No. 635723-84-1

  • Cat. No. CS-W021429
  • Purity≥97%
  • MDL No.MFCD12025416

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

2-(Bromomethyl)-3-fluorobenzonitrile|CS-W021429

Structure of 635723-84-1

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General Information

  • CAS No. 635723-84-1
  • Cat. No. CS-W021429
  • Purity ≥97%
  • MDL No. MFCD12025416
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅BrFN
  • Molecular Weight 214.04
  • Synonym(s) 3-Fluoro-2-(bromomethyl)benzonitrile
  • SMILES N#CC1=CC=CC(F)=C1CBr

Synthesis

  • Route1

    References

    • H. LUNDBECK A/S; MARIGO, Mauro; KILBURN, John Paul; NIELSEN, Jacob; PÜSCHL, Ask; LANGGÅRD, Morten; JESSING, Mikkel; KEHLER, Jan Patent: WO2013/45607 A1, 2013 ; Location in patent: Page/Page column 29 ;

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅱ
Hazard Statements : H302-H314
Precautionary Statements : P260-P264-P270-P280-P301+P330+P331-P304+P340-P363-P405-P501

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.59228
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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