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Home > Boronic Acids > 710348-21-3
710348-21-3 | N-(4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanesulfonamide
CAS No: 710348-21-3 Catalog No: AG01C9ON MDL No:MFCD22494198
Product Description
Catalog Number:
AG01C9ON
Chemical Name:
N-(4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanesulfonamide
CAS Number:
710348-21-3
Molecular Formula:
C14H22BNO4S
Molecular Weight:
311.2048
MDL Number:
MFCD22494198
IUPAC Name:
N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide
InChI:
InChI=1S/C14H22BNO4S/c1-10-7-8-11(16-21(6,17)18)9-12(10)15-19-13(2,3)14(4,5)20-15/h7-9,16H,1-6H3
InChI Key:
SUCCUAMVSDTYKS-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)NS(=O)(=O)C
Properties
Complexity:
470
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.136g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
311.203g/mol
Monoisotopic Mass:
311.136g/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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