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398489-42-4,MFCD17480496
Catalog No.:AA00I7QT

398489-42-4 | tert-Butyl 3-hydroxy-3-(trifluoromethyl)azetidine-1-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$145.00   $102.00
- +
1g
95%
in stock  
$156.00   $109.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00I7QT
Chemical Name:
tert-Butyl 3-hydroxy-3-(trifluoromethyl)azetidine-1-carboxylate
CAS Number:
398489-42-4
Molecular Formula:
C9H14F3NO3
Molecular Weight:
241.2076
MDL Number:
MFCD17480496
SMILES:
O=C(N1CC(C1)(O)C(F)(F)F)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
289  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.2  

Downstream Synthesis Route

[1]CurrentPatentAssignee:MERCK&COINC-WO2009/54941,2009,A1Locationinpatent:Page/Pagecolumn63-64

[1]CurrentPatentAssignee:MERCK&COINC-WO2009/54941,2009,A1Locationinpatent:Page/Pagecolumn63

398489-42-4    75-03-6   
tert-butyl3-ethoxy-3-(trifluoromethyl)azetidine-1-carboxylate 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2017/191098,2017,A1Locationinpatent:Page/Pagecolumn233;234

Literature
Quotation Request
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Additional Info:
SDS
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Tags:398489-42-4 Molecular Formula|398489-42-4 MDL|398489-42-4 SMILES|398489-42-4 tert-Butyl 3-hydroxy-3-(trifluoromethyl)azetidine-1-carboxylate