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Home > Boronic Acids > 850568-74-0
850568-74-0 | 3-Boronobenzenesulfonamide
CAS No: 850568-74-0 Catalog No: AG0036FT MDL No:MFCD06659840
Product Description
Catalog Number:
AG0036FT
Chemical Name:
3-Boronobenzenesulfonamide
CAS Number:
850568-74-0
Molecular Formula:
C6H8BNO4S
Molecular Weight:
201.0080
MDL Number:
MFCD06659840
IUPAC Name:
(3-sulfamoylphenyl)boronic acid
InChI:
InChI=1S/C6H8BNO4S/c8-13(11,12)6-3-1-2-5(4-6)7(9)10/h1-4,9-10H,(H2,8,11,12)
InChI Key:
PMNJSWJJYWZLHU-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)S(=O)(=O)N)O
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.027g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
201.003g/mol
Monoisotopic Mass:
201.027g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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