108749-15-1,MFCD08436066
Catalog No.:AA007TXC

108749-15-1 | 3-Acetamido-5-boronobenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$278.00   $195.00
- +
5g
98%
in stock  
$1,078.00 $755.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA007TXC
Chemical Name:
3-Acetamido-5-boronobenzoic acid
CAS Number:
108749-15-1
Molecular Formula:
C9H10BNO5
Molecular Weight:
222.9904
MDL Number:
MFCD08436066
SMILES:
CC(=O)Nc1cc(cc(c1)C(=O)O)B(O)O
Properties
Computed Properties
 
Complexity:
283  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Downstream Synthesis Route

[1]Inglis,StevenR.;Zervosen,Astrid;Woon,EstherC.Y.;Gerards,Thomas;Teller,Nathalie;Fischer,DelphineS.;Luxen,André;Schofield,ChristopherJ.[JournalofMedicinalChemistry,2009,vol.52,#19,p.6097-6106]

N-(3-bromo-1-naphthyl)-2,3,5,6-tetramethyl-benzenesulfonamide 
  108749-15-1   
3-acetamido-5-4-(2,3,5,6-tetramethylphenyl)sulfonylamino-2-naphthylbenzoicacid 

[1]CurrentPatentAssignee:SANOFI-EP2998295,2016,A1Locationinpatent:Page/Pagecolumn20

Literature

Title: Synthesis and evaluation of 3-(dihydroxyboryl)benzoic acids as D,D-carboxypeptidase R39 inhibitors.

Journal: Journal of medicinal chemistry 20091008

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Tags:108749-15-1 Molecular Formula|108749-15-1 MDL|108749-15-1 SMILES|108749-15-1 3-Acetamido-5-boronobenzoic acid
Catalog No.: AA007TXC
108749-15-1,MFCD08436066
108749-15-1 | 3-Acetamido-5-boronobenzoic acid
Pack Size: 1g
Purity: 98%
in stock
$278.00 $195.00
Pack Size: 5g
Purity: 98%
in stock
$1,078.00 $755.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA007TXC
Chemical Name: 3-Acetamido-5-boronobenzoic acid
CAS Number: 108749-15-1
Molecular Formula: C9H10BNO5
Molecular Weight: 222.9904
MDL Number: MFCD08436066
SMILES: CC(=O)Nc1cc(cc(c1)C(=O)O)B(O)O
Properties
Complexity: 283  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 4  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Downstream Synthesis Route
1071959-03-9    108749-15-1 

[1]Inglis,StevenR.;Zervosen,Astrid;Woon,EstherC.Y.;Gerards,Thomas;Teller,Nathalie;Fischer,DelphineS.;Luxen,André;Schofield,ChristopherJ.[JournalofMedicinalChemistry,2009,vol.52,#19,p.6097-6106]

N-(3-bromo-1-naphthyl)-2,3,5,6-tetramethyl-benzenesulfonamide 
  108749-15-1   
3-acetamido-5-4-(2,3,5,6-tetramethylphenyl)sulfonylamino-2-naphthylbenzoicacid 

[1]CurrentPatentAssignee:SANOFI-EP2998295,2016,A1Locationinpatent:Page/Pagecolumn20

Literature fold

Title: Synthesis and evaluation of 3-(dihydroxyboryl)benzoic acids as D,D-carboxypeptidase R39 inhibitors.

Journal: Journal of medicinal chemistry20091008

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