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Home > Boronic Acids > 928657-23-2
928657-23-2 | 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenemethanesulfonamide
CAS No: 928657-23-2 Catalog No: AG00H5CJ MDL No:MFCD18779851
Product Description
Catalog Number:
AG00H5CJ
Chemical Name:
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenemethanesulfonamide
CAS Number:
928657-23-2
Molecular Formula:
C13H20BNO4S
Molecular Weight:
297.1782
MDL Number:
MFCD18779851
IUPAC Name:
[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide
InChI:
InChI=1S/C13H20BNO4S/c1-12(2)13(3,4)19-14(18-12)11-7-5-10(6-8-11)9-20(15,16)17/h5-8H,9H2,1-4H3,(H2,15,16,17)
InChI Key:
GIAWTHCXIKEOIY-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(cc1)CS(=O)(=O)N
Properties
Complexity:
434
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.121g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
297.176g/mol
Monoisotopic Mass:
297.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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