Home Boronic Acids 486422-05-3
486422-05-3,MFCD07368237
Catalog No.:AA003I6S
486422-05-3 | 3-(N,N-Dimethylsulfamoyl)phenylboronic acid, pinacol ester
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1g
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$129.00   $90.00
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5g
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$572.00   $400.00
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Technical Information
Catalog Number:
AA003I6S
Chemical Name:
3-(N,N-Dimethylsulfamoyl)phenylboronic acid, pinacol ester
CAS Number:
486422-05-3
Molecular Formula:
C14H22BNO4S
Molecular Weight:
311.2048
MDL Number:
MFCD07368237
IUPAC Name:
N,N-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamide
InChI:
InChI=1S/C14H22BNO4S/c1-13(2)14(3,4)20-15(19-13)11-8-7-9-12(10-11)21(17,18)16(5)6/h7-10H,1-6H3
InChI Key:
YFEWVSRTWWHXFP-UHFFFAOYSA-N
SMILES:
CN(S(=O)(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C)C
Properties
Computed Properties
 
Complexity:
468  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.136g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.203g/mol
Monoisotopic Mass:
311.136g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
486422-05-3 
3-(N,N-Dimethylaminosulfonyl)phenylboronic acid pinacol ester 
ZINC169835865 
AB31969 
RTR-017713 
TR-017713 
C-1763 
N,N -Dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamide 
N,N-Dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene-1-sulfonamide 
2-Bromo-1-(5-bromo-2-chlorophenyl)ethanone 
3-(N,N-Dimethylsulfamoyl)phenylboronic acid pinacol ester 
4,4,5,5-Tetramethyl-2-(3-(dimethylsulfamoyl)phenyl)-1,3,2-dioxaborolane 
N,N-DIMETHYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZENESULFONAMIDE 
3-(DIHYDROXYBORANE PINACOL ESTER)PHENYLDIMETHYLSULFONAMIDE 
3-(N,N-DIMETHYLSULFAMOYL)PHENYLBORONIC ACID, PINACOL ESTER 
SCHEMBL1674134 
CTK8B3392 
DTXSID50585953 
ANW-42454 
MFCD07368237 
Literature
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