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Home > Boronic Acids > 911228-95-0
911228-95-0 | N,N-diethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene-1-sulfonamide
CAS No: 911228-95-0 Catalog No: AG00J0F7 MDL No:MFCD27957314
Product Description
Catalog Number:
AG00J0F7
Chemical Name:
N,N-diethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene-1-sulfonamide
CAS Number:
911228-95-0
Molecular Formula:
C16H26BNO4S
Molecular Weight:
339.2579
MDL Number:
MFCD27957314
IUPAC Name:
N,N-diethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamide
InChI:
InChI=1S/C16H26BNO4S/c1-7-18(8-2)23(19,20)14-11-9-13(10-12-14)17-21-15(3,4)16(5,6)22-17/h9-12H,7-8H2,1-6H3
InChI Key:
CRSLAGARSMICFC-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)CC
Properties
Complexity:
487
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.168g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.257g/mol
Monoisotopic Mass:
339.168g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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