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Home > Boronic Acids > 380430-60-4
380430-60-4 | N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide
CAS No: 380430-60-4 Catalog No: AG00I7HJ MDL No:MFCD02179479
Product Description
Catalog Number:
AG00I7HJ
Chemical Name:
N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide
CAS Number:
380430-60-4
Molecular Formula:
C13H20BNO4S
Molecular Weight:
297.1782
MDL Number:
MFCD02179479
IUPAC Name:
N-[2-(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)10-8-6-7-9-11(10)15-20(5,16)17/h6-9,15H,1-5H3
InChI Key:
ADAOINPTCZWNBZ-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)Nc1ccccc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
442
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:
73A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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