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Home Boronic Acids 761446-45-1
761446-45-1,MFCD03789252
Catalog No.:AA003DWJ

761446-45-1 | 1-Benzylpyrazole-4-boronic acid, pinacol ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$7.00   $5.00
- +
1g
97%
in stock  
$17.00   $12.00
- +
5g
97%
in stock  
$25.00   $18.00
- +
10g
97%
in stock  
$48.00   $34.00
- +
25g
97%
in stock  
$120.00   $84.00
- +
  • 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:
AA003DWJ
Chemical Name:
1-Benzylpyrazole-4-boronic acid, pinacol ester
CAS Number:
761446-45-1
Molecular Formula:
C16H21BN2O2
Molecular Weight:
284.1611
MDL Number:
MFCD03789252
SMILES:
CC1(C)OB(OC1(C)C)c1cnn(c1)Cc1ccccc1
Properties
Properties
 
BP:
427.9°C at 760 mmHg  
Form:
Solid  
MP:
86-90 °C(lit.)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
353  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  

Upstream Synthesis Route

[1]Patent:US2018/296543,2018,A1,.Locationinpatent:Paragraph0573;0574;0600

[2]Patent:WO2015/95767,2015,A1,.Locationinpatent:Page/Pagecolumn284;285

[3]Patent:WO2016/124508,2016,A1,.Locationinpatent:Page/Pagecolumn55

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

[5]Patent:WO2014/60395,2014,A1,.Locationinpatent:Page/Pagecolumn35

[1]Patent:US8080566,2011,B1,.Locationinpatent:Page/Pagecolumn57

[2]Patent:WO2016/615,2016,A1,.Locationinpatent:Paragraph00556

[1]ChemicalScience,2015,vol.6,#5,p.2943-2951

[1]OrganicandBiomolecularChemistry,2011,vol.9,#9,p.3139-3141

[1]Patent:US8080566,2011,B1,

[2]Patent:WO2016/615,2016,A1,

Downstream Synthesis Route
1000793-42-9    761446-45-1   
2-6-(1-benzyl-1H-pyrazol-4-yl)-2,3-dihydrobenzo1,4oxazin-4-yl-6,6-dimethyl-6,7-dihydro1,3thiazolo5,4-cpyridin-4(5H)-one 

[1]Patent:WO2008/1076,2008,A1.Locationinpatent:Page/Pagecolumn188

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

C29H22BrN3OS 
  761446-45-1   
C39H31N5OS 

[1]Patent:US2006/154973,2006,A1.Locationinpatent:Page/Pagecolumn43

2033-46-7    761446-45-1   
N-5-(1-benzyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazol-2-ylacetamide 

[1]Patent:WO2007/82956,2007,A1.Locationinpatent:Page/Pagecolumn51

[1]Patent:WO2008/154241,2008,A1.Locationinpatent:Page/Pagecolumn148-149

[1]Patent:WO2008/154241,2008,A1.Locationinpatent:Page/Pagecolumn140

Literature
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Additional Info:
SDS
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Tags:761446-45-1 Molecular Formula|761446-45-1 MDL|761446-45-1 SMILES|761446-45-1 1-Benzylpyrazole-4-boronic acid, pinacol ester