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Home Boronic Acids 850568-76-2
850568-76-2,MFCD06659846
Catalog No.:AA008GQF

850568-76-2 | N,N-Diethyl 4-boronobenzenesulfonamide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$71.00   $50.00
- +
1g
98%
in stock  
$185.00   $130.00
- +
5g
98%
in stock  
$772.00   $540.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA008GQF
Chemical Name:
N,N-Diethyl 4-boronobenzenesulfonamide
CAS Number:
850568-76-2
Molecular Formula:
C10H16BNO4S
Molecular Weight:
257.1143
MDL Number:
MFCD06659846
SMILES:
CCN(S(=O)(=O)c1ccc(cc1)B(O)O)CC
Properties
Computed Properties
 
Complexity:
316  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
5  

Downstream Synthesis Route
849519-42-2    850568-76-2   
4'-2-((R)-2-methyl-pyrrolidin-1-yl)-ethyl-biphenyl-4-sulfonicaciddiethylamidehydrochloride 

[1]Locationinpatent:experimentalpartCovel,JonathanA.;Santora,VincentJ.;Smith,JeffreyM.;Hayashi,Rena;Gallardo,Charlemagne;Weinhouse,MichaelI.;Ibarra,JasonB.;Schultz,JeffreyA.;Park,DouglasM.;Estrada,ScottA.;Hofilena,BrianJ.;Pulley,MichelleD.;Smith,BrianM.;Ren,Albert;Suarez,Marissa;Frazer,John;Edwards,Jeffrey;Hauser,ErinK.;Lorea,Jodie;Semple,Graeme;Grottick,AndrewJ.[JournalofMedicinalChemistry,2009,vol.52,#18,p.5603-5611]

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2013/225588,2013,A1Locationinpatent:Paragraph0370;0371

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2013/225588,2013,A1Locationinpatent:Paragraph0409;0410

850568-76-2   
C33H45BrO12 
 
C43H59NO14S 

[1]Wender,PaulA.;Staveness,Daryl[OrganicLetters,2014,vol.16,#19,p.5140-5143]

850568-76-2   
C14H17BrO6 
 
C24H31NO8S 

[1]Staveness,Daryl;Abdelnabi,Rana;Near,KatherineE.;Nakagawa,Yu;Neyts,Johan;Delang,Leen;Leyssen,Pieter;Wender,PaulA.[JournalofNaturalProducts,2016,vol.79,#4,p.680-684]

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SDS
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Tags:850568-76-2 Molecular Formula|850568-76-2 MDL|850568-76-2 SMILES|850568-76-2 N,N-Diethyl 4-boronobenzenesulfonamide