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Home Bromides 1129540-72-2
1129540-72-2,MFCD15525418
Catalog No.:AA00HCDM

1129540-72-2 | 4-(3-Bromo-1h-1,2,4-triazol-1-yl)aniline

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Purity
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2.5g
95%
2 weeks  
$1,970.00   $1,379.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00HCDM
Chemical Name:
4-(3-Bromo-1h-1,2,4-triazol-1-yl)aniline
CAS Number:
1129540-72-2
Molecular Formula:
C8H7BrN4
Molecular Weight:
239.0720
MDL Number:
MFCD15525418
SMILES:
Nc1ccc(cc1)n1cnc(n1)Br
Properties
Computed Properties
 
Complexity:
170  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2  

Downstream Synthesis Route

[1]CurrentPatentAssignee:CORTEVAINC-WO2021/11722,2021,A1Locationinpatent:Page/Pagecolumn324-325

[2]CurrentPatentAssignee:SCRIPPSRESEARCH-WO2009/32861,2009,A1Locationinpatent:Page/Pagecolumn77

[3]Locationinpatent:schemeortableKamenecka,Ted;Jiang,Rong;Song,Xinyi;Duckett,Derek;Chen,Weimin;Ling,YuanYuan;Habel,Jeff;Laughlin,JohnD.;Chambers,Jeremy;Figuera-Losada,Mariana;Cameron,MichaelD.;Lin,Li;Ruiz,ClaudiaH.;LoGrasso,PhilipV.[JournalofMedicinalChemistry,2010,vol.53,#1,p.419-431]

[1]Locationinpatent:experimentalpartKamenecka,Ted;Jiang,Rong;Song,Xinyi;Duckett,Derek;Chen,Weimin;Ling,YuanYuan;Habel,Jeff;Laughlin,JohnD.;Chambers,Jeremy;Figuera-Losada,Mariana;Cameron,MichaelD.;Lin,Li;Ruiz,ClaudiaH.;LoGrasso,PhilipV.[JournalofMedicinalChemistry,2010,vol.53,#1,p.419-431]

[1]Locationinpatent:experimentalpartKamenecka,Ted;Jiang,Rong;Song,Xinyi;Duckett,Derek;Chen,Weimin;Ling,YuanYuan;Habel,Jeff;Laughlin,JohnD.;Chambers,Jeremy;Figuera-Losada,Mariana;Cameron,MichaelD.;Lin,Li;Ruiz,ClaudiaH.;LoGrasso,PhilipV.[JournalofMedicinalChemistry,2010,vol.53,#1,p.419-431]

1129540-72-2   
(4-(3-bromo-1H-1,2,4-triazol-1-yl)phenyl)(trifluoromethyl)carbamicfluoride 

[1]CurrentPatentAssignee:CORTEVAINC-WO2021/11722,2021,A1

1129540-72-2   
methyl(4-(3-bromo-1H-1,2,4-triazol-1-yl)phenyl)(trifluoromethyl)carbamate 

[1]CurrentPatentAssignee:CORTEVAINC-WO2021/11722,2021,A1

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SDS
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Tags:1129540-72-2 Molecular Formula|1129540-72-2 MDL|1129540-72-2 SMILES|1129540-72-2 4-(3-Bromo-1h-1,2,4-triazol-1-yl)aniline