Home Boronic Acids 913836-00-7
913836-00-7,MFCD09027231
Catalog No.:AA006N7J

913836-00-7 | 4-Boronobenzenesulfonic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$178.00   $125.00
- +
250mg
98%
in stock  
$344.00   $241.00
- +
1g
98%
in stock  
$1,092.00   $764.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA006N7J
Chemical Name:
4-Boronobenzenesulfonic acid
CAS Number:
913836-00-7
Molecular Formula:
C6H7BO5S
Molecular Weight:
201.9928
MDL Number:
MFCD09027231
SMILES:
OB(c1ccc(cc1)S(=O)(=O)O)O
Properties
Properties
 
Storage:
2-8℃;  

Computed Properties
 
Complexity:
249  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
2  

Downstream Synthesis Route
trans-4-3-bromo-6-(butylamino)-1H-pyrazolo3,4-dpyrimidin-1-ylcyclohexan-1-ol 
  913836-00-7   
4-(1-(trans-4-hydroxycyclohexyl)-6-(butylamino)-1H-pyrazolo3,4-dpyrimidin-3-yl)benzenesulfonicacid 

[1]Liu,Jing;Zhang,Weihe;Stashko,MichaelA.;DeRyckere,Deborah;Cummings,ChristopherT.;Hunter,Debra;Yang,Chao;Jayakody,ChaturaN.;Cheng,Nancy;Simpson,Catherine;Norris-Drouin,Jacqueline;Sather,Susan;Kireev,Dmitri;Janzen,WilliamP.;Earp,H.Shelton;Graham,DouglasK.;Frye,StephenV.;Wang,Xiaodong[EuropeanJournalofMedicinalChemistry,2013,vol.65,p.83-93]

Literature
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SDS
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Tags:913836-00-7 Molecular Formula|913836-00-7 MDL|913836-00-7 SMILES|913836-00-7 4-Boronobenzenesulfonic acid