Home Boronic Acids 957121-13-0
957121-13-0,MFCD09800889
Catalog No.:AA00IJBH
N-(4-Fluorophenyl) 4-boronobenzenesulfonamide | 957121-13-0
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1g
98%
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$144.00
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5g
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$410.00
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  • Technical Information
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00IJBH
Chemical Name:
N-(4-Fluorophenyl) 4-boronobenzenesulfonamide
CAS Number:
957121-13-0
Molecular Formula:
C12H11BFNO4S
Molecular Weight:
295.0944
MDL Number:
MFCD09800889
IUPAC Name:
[4-[(4-fluorophenyl)sulfamoyl]phenyl]boronic acid
InChI:
InChI=1S/C12H11BFNO4S/c14-10-3-5-11(6-4-10)15-20(18,19)12-7-1-9(2-8-12)13(16)17/h1-8,15-17H
InChI Key:
MFWQIJUPTCPQPU-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)NS(=O)(=O)c1ccc(cc1)B(O)O
Properties
Computed Properties
 
Complexity:
398  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.049g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
295.091g/mol
Monoisotopic Mass:
295.049g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
95A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
957121-13-0 
N-(4-Fluorophenyl) 4-boronobenzenesulfonamide 
DTXSID40660309 
MFWQIJUPTCPQPU-UHFFFAOYSA-N 
ZX-AP009255 
ANW-40727 
PC8049 
AKOS015833536 
ZINC169744091 
RTR-030047 
AX8230483 
TR-030047 
(4-(N-(4-Fluorophenyl)sulfamoyl)phenyl)boronic acid 
N-(4-Fluorophenyl)4-boronobenzenesulfonamide 
ST24020511 
V9829 
4-Borono-N-(4-fluorophenyl)benzenesulphonamide 
B-1235 
4-[(4-fluorophenyl)sulfamoyl]phenylboronic acid 
{4-[(4-Fluorophenyl)sulfamoyl]phenyl}boronic acid 
4-(N-(4-fluorophenyl)sulfamoyl)-phenylboronic acid 
(4-(N-(4-Fluorophenyl)sulfamoyl)-phenyl)boronic acid 
I01-10616 
MFCD09800889 
(4-(N-(4-Fluorophenyl)sulfamoyl)phenyl)boronicacid 
4-(N-(4-fluorophenyl)sulfamoyl)phenylboronic acid 
4-[N-(4-Fluorophenyl)sulphamoyl]benzeneboronic acid 
ACMC-209s4p 
C12H11BFNO4S 
SCHEMBL15208748 
CTK5H8117 
Literature
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