Home Boronic acids 3-(3-Bromophenylsulfonamido)phenylboronic acid

3-(3-Bromophenylsulfonamido)phenylboronic acid

CAS No.:
913835-31-1
Catalog Number:
AG00GTDB
Molecular Formula:
C12H11BBrNO4S
Molecular Weight:
356.0000
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$105
- +
5g
95%
In Stock USA
United States
$394
- +
Product Description
Catalog Number:
AG00GTDB
Chemical Name:
3-(3-Bromophenylsulfonamido)phenylboronic acid
CAS Number:
913835-31-1
Molecular Formula:
C12H11BBrNO4S
Molecular Weight:
356.0000
MDL Number:
MFCD08436047
IUPAC Name:
[3-[(3-bromophenyl)sulfonylamino]phenyl]boronic acid
InChI:
InChI=1S/C12H11BBrNO4S/c14-10-4-2-6-12(8-10)20(18,19)15-11-5-1-3-9(7-11)13(16)17/h1-8,15-17H
InChI Key:
AJQSIDSDMAZIHA-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)S(=O)(=O)Nc1cccc(c1)B(O)O
Properties
Complexity:
414  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.969g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
355.997g/mol
Monoisotopic Mass:
354.969g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
95A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties