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Home Boronic Acids 864754-21-2
864754-21-2,MFCD08706029
Catalog No.:AA004QMV

864754-21-2 | 1-(Pyridin-3-ylmethyl)-1H-pyrazole-4-boronic acid, pinacol ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$14.00   $10.00
- +
250mg
95%
in stock  
$17.00   $12.00
- +
5g
95%
in stock  
$328.00   $230.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA004QMV
Chemical Name:
1-(Pyridin-3-ylmethyl)-1H-pyrazole-4-boronic acid, pinacol ester
CAS Number:
864754-21-2
Molecular Formula:
C15H20BN3O2
Molecular Weight:
285.1492
MDL Number:
MFCD08706029
SMILES:
CC1(C)OB(OC1(C)C)c1cnn(c1)Cc1cccnc1
Properties
Properties
 
BP:
450.6°C at 760 mmHg  
Form:
Solid  
MP:
102-106℃  
Storage:
2-8℃;Light sensitive;Keep in dry area;  

Computed Properties
 
Complexity:
362  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
3  

Upstream Synthesis Route

[1]Patent:CN106749268,2017,A,.Locationinpatent:Paragraph0607;0608

[1]Patent:WO2010/10186,2010,A1,.Locationinpatent:Page/Pagecolumn57

[1]JournalofMedicinalChemistry,2016,vol.59,#4,p.1370-1387

Downstream Synthesis Route
1000793-42-9    864754-21-2   
6,6-dimethyl-2-{6-1-(pyridin-3-ylmethyl)-1H-pyrazol-4-yl-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-6,7-dihydro1,3thiazolo5,4-cpyridin-4(5H)-one 

[1]Patent:WO2008/1076,2008,A1.Locationinpatent:Page/Pagecolumn295-296

[2]BioorganicandMedicinalChemistryLetters,2008,vol.18,p.5299-5302

[1]Patent:WO2010/10186,2010,A1.Locationinpatent:Page/Pagecolumn57

[1]Patent:WO2014/6554,2014,A1.Locationinpatent:Page/Pagecolumn136

[1]Patent:WO2014/6554,2014,A1.Locationinpatent:Page/Pagecolumn119

Literature
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SDS
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Tags:864754-21-2 Molecular Formula|864754-21-2 MDL|864754-21-2 SMILES|864754-21-2 1-(Pyridin-3-ylmethyl)-1H-pyrazole-4-boronic acid, pinacol ester