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Home Bromides 853368-35-1
853368-35-1,MFCD18394044
Catalog No.:AA00G9UZ

853368-35-1 | 3-(Bromomethyl)-5-fluorobenzonitrile

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Purity
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250mg
in stock  
$78.00   $55.00
- +
1g
in stock  
$81.00   $57.00
- +
5g
in stock  
$118.00   $83.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00G9UZ
Chemical Name:
3-(Bromomethyl)-5-fluorobenzonitrile
CAS Number:
853368-35-1
Molecular Formula:
C8H5BrFN
Molecular Weight:
214.0344
MDL Number:
MFCD18394044
SMILES:
BrCc1cc(C#N)cc(c1)F
Properties
Computed Properties
 
Complexity:
174  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
2.3  

Downstream Synthesis Route

[1]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-EP2077262,2009,A1Locationinpatent:Page/Pagecolumn72

[1]Patent:WO2019/183587,2019,A1.Locationinpatent:Page/Pagecolumn127-129;148-149;176

[2]Patent:WO2010/112461,2010,A1.Locationinpatent:Page/Pagecolumn70

[3]Patent:WO2011/12622,2011,A1.Locationinpatent:Page/Pagecolumn119;120

[4]ChemMedChem,2015,vol.10,p.688-714

[1]Patent:WO2012/4287,2012,A1.Locationinpatent:Page/Pagecolumn74

[1]Battisti,UmbertoM.;García-Vázquez,Rocío;Svatunek,Dennis;Herrmann,Barbara;Löffler,Andreas;Mikula,Hannes;Herth,MatthiasManfred[BioconjugateChemistry,2022,vol.33,#4,p.608-624]

Literature
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SDS
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Tags:853368-35-1 Molecular Formula|853368-35-1 MDL|853368-35-1 SMILES|853368-35-1 3-(Bromomethyl)-5-fluorobenzonitrile