4-Methanesulfonylaminophenylboronic acid, pinacol ester

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Catalog Number
ACM616880149-1
Product Name
4-Methanesulfonylaminophenylboronic acid, pinacol ester
Structure
Structure
CAS
616880-14-9
Category
Boronic Esters
IUPAC Name
N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide
Molecular Weight
297.2g/mol
Molecular Formula
C13H20BNO4S
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)NS(=O)(=O)C
InChI
InChI=1S/C13H20BNO4S/c1-12(2)13(3,4)19-14(18-12)10-6-8-11(9-7-10)15-20(5,16)17/h6-9,15H,1-5H3
InChI Key
NPSPNWPZDXQYAC-UHFFFAOYSA-N
Complexity
434
Covalently-Bonded Unit Count
1
Exact Mass
297.12061g/mol
Formal Charge
0
H-Bond Acceptor
5
H-Bond Donor
1
Heavy Atom Count
20
Monoisotopic Mass
297.12061g/mol
Rotatable Bond Count
3
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