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Home > Boronic Acids > 1367368-40-8
1367368-40-8 | 4-methyl-N'-[(1E)-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methylidene]benzene-1-sulfonohydrazide
CAS No: 1367368-40-8 Catalog No: AG00HUON MDL No:MFCD28127160
Product Description
Catalog Number:
AG00HUON
Chemical Name:
4-methyl-N'-[(1E)-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methylidene]benzene-1-sulfonohydrazide
CAS Number:
1367368-40-8
Molecular Formula:
C20H25BN2O4S
Molecular Weight:
400.2995
MDL Number:
MFCD28127160
IUPAC Name:
4-methyl-N-[(E)-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methylideneamino]benzenesulfonamide
InChI:
InChI=1S/C20H25BN2O4S/c1-15-6-12-18(13-7-15)28(24,25)23-22-14-16-8-10-17(11-9-16)21-26-19(2,3)20(4,5)27-21/h6-14,23H,1-5H3/b22-14+
InChI Key:
JTOBBSYXOGLTMQ-HYARGMPZSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)N/N=C/c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
642
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
400.163g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
400.3g/mol
Monoisotopic Mass:
400.163g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
85.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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