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Home > Boronic Acids > 1083326-28-6
1083326-28-6 | N-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)benzenesulfonamide
CAS No: 1083326-28-6 Catalog No: AG008Z80 MDL No:MFCD13190589
Product Description
Catalog Number:
AG008Z80
Chemical Name:
N-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)benzenesulfonamide
CAS Number:
1083326-28-6
Molecular Formula:
C17H21BN2O4S
Molecular Weight:
360.2356
MDL Number:
MFCD13190589
IUPAC Name:
N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]benzenesulfonamide
InChI:
InChI=1S/C17H21BN2O4S/c1-16(2)17(3,4)24-18(23-16)13-10-14(12-19-11-13)20-25(21,22)15-8-6-5-7-9-15/h5-12,20H,1-4H3
InChI Key:
UXJVHVXONVGHIL-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cncc(c1)NS(=O)(=O)c1ccccc1
Properties
Complexity:
554
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.132g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
360.235g/mol
Monoisotopic Mass:
360.132g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
85.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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