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Home > Boronic Acids > 942070-58-8
942070-58-8 | N,N-DIMETHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-IMIDAZOLE-1-SULFONAMIDE
CAS No: 942070-58-8 Catalog No: AG006OCZ MDL No:
Product Description
Catalog Number:
AG006OCZ
Chemical Name:
N,N-DIMETHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-IMIDAZOLE-1-SULFONAMIDE
CAS Number:
942070-58-8
Molecular Formula:
C11H20BN3O4S
Molecular Weight:
301.1702
IUPAC Name:
N,N-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazole-1-sulfonamide
InChI:
InChI=1S/C11H20BN3O4S/c1-10(2)11(3,4)19-12(18-10)9-7-15(8-13-9)20(16,17)14(5)6/h7-8H,1-6H3
InChI Key:
ZWQXNFBXPCSFAO-UHFFFAOYSA-N
SMILES:
CN(S(=O)(=O)n1cnc(c1)B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
459
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.127g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.168g/mol
Monoisotopic Mass:
301.127g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
82A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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