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723286-98-4,MFCD09699166
Catalog No.:AA0032SH

723286-98-4 | 5-(Chloromethyl)-2-(trifluoromethyl)-1,3,4-oxadiazole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$31.00   $22.00
- +
5g
95%
in stock  
$89.00   $62.00
- +
100g
98%
in stock  
$1,640.00   $1,148.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0032SH
Chemical Name:
5-(Chloromethyl)-2-(trifluoromethyl)-1,3,4-oxadiazole
CAS Number:
723286-98-4
Molecular Formula:
C4H2ClF3N2O
Molecular Weight:
186.5197
MDL Number:
MFCD09699166
SMILES:
ClCc1nnc(o1)C(F)(F)F
Properties
Properties
 
BP:
144.3°C at 760 mmHg  
Form:
Liquid  
Storage:
Inert atmosphere;-20 ℃;  

Computed Properties
 
Complexity:
142  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
6  
Rotatable Bond Count:
1  
XLogP3:
1.1  

Downstream Synthesis Route

[1]Kim,Dooseop;Kowalchick,JenniferE.;Brockunier,LindaL.;Parmee,EmmaR.;Eiermann,GeorgeJ.;Fisher,MichaelH.;He,Huaibing;Leiting,Barbara;Lyons,Kathryn;Scapin,Giovanna;Patel,SangitaB.;Petrov,Aleksandr;Pryor,KellyAnnD.;Roy,RanabirSinha;Wu,JosephK.;Zhang,Xiaoping;Wyvratt,MatthewJ.;Zhang,BeiB.;Zhu,Lan;Thornberry,NancyA.;Weber,AnnE.[JournalofMedicinalChemistry,2008,vol.51,#3,p.589-602]

[2]CurrentPatentAssignee:MERCK&COINC-WO2004/58266,2004,A1Locationinpatent:Page/Pagecolumn89

[1]Patent:WO2010/122578,2010,A2.Locationinpatent:Page/Pagecolumn54-55

723286-98-4    42869-47-6   
2-((6-bromo-2-methyl-1H-imidazo4,5-bpyridin-1-yl)methyl)-5-(trifluoromethyl)-1,3,4-oxadiazole 

[1]Patent:EP3450436,2019,A1.Locationinpatent:Paragraph0476

Literature
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SDS
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Tags:723286-98-4 Molecular Formula|723286-98-4 MDL|723286-98-4 SMILES|723286-98-4 5-(Chloromethyl)-2-(trifluoromethyl)-1,3,4-oxadiazole