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Home Boronic Acids 1025719-23-6
1025719-23-6,MFCD12828677
Catalog No.:AA0007PF

1025719-23-6 | 1-Methyl-3-(trifluoromethyl)pyrazole-5-boronic acid pinacol ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$12.00   $8.00
- +
250mg
98%
in stock  
$14.00   $10.00
- +
1g
98%
in stock  
$47.00   $33.00
- +
5g
98%
in stock  
$168.00   $117.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0007PF
Chemical Name:
1-Methyl-3-(trifluoromethyl)pyrazole-5-boronic acid pinacol ester
CAS Number:
1025719-23-6
Molecular Formula:
C11H16BF3N2O2
Molecular Weight:
276.0631
MDL Number:
MFCD12828677
SMILES:
FC(c1cc(n(n1)C)B1OC(C(O1)(C)C)(C)C)(F)F
Properties
Computed Properties
 
Complexity:
346  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Rotatable Bond Count:
1  

Downstream Synthesis Route
CASUnavailable 
  1025719-23-6    1788061-04-0 

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US2015/152108,2015,A1Locationinpatent:Paragraph01501;1502;1503

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2016/79709,2016,A1Locationinpatent:Page/Pagecolumn534

[1]Sato,Kenjiro;Takahagi,Hiroki;Kubo,Osamu;Hidaka,Kousuke;Yoshikawa,Takeshi;Kamaura,Masahiro;Nakakariya,Masanori;Amano,Nobuyuki;Adachi,Ryutaro;Maki,Toshiyuki;Take,Kazumi;Takekawa,Shiro;Kitazaki,Tomoyuki;Maekawa,Tsuyoshi[BioorganicandMedicinalChemistry,2015,vol.23,#15,p.4544-4560]

CASUnavailable 
  1025719-23-6    1984826-34-7 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2016/128529,2016,A1Locationinpatent:Paragraph0975;0976;0977

CASUnavailable 
  1025719-23-6    1984826-36-9 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2016/128529,2016,A1

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2017/144483,2017,A1Locationinpatent:Page/Pagecolumn25;29

Literature
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SDS
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Tags:1025719-23-6 Molecular Formula|1025719-23-6 MDL|1025719-23-6 SMILES|1025719-23-6 1-Methyl-3-(trifluoromethyl)pyrazole-5-boronic acid pinacol ester