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165070-56-4 | Benzenesulfonamide, 4-hydroperoxy-
CAS No: 165070-56-4 Catalog No: AG001V96 MDL No:
Product Description
Catalog Number:
AG001V96
Chemical Name:
Benzenesulfonamide, 4-hydroperoxy-
CAS Number:
165070-56-4
Molecular Formula:
C6H7NO4S
Molecular Weight:
189.1891
IUPAC Name:
4-hydroperoxybenzenesulfonamide
InChI:
InChI=1S/C6H7NO4S/c7-12(9,10)6-3-1-5(11-8)2-4-6/h1-4,8H,(H2,7,9,10)
InChI Key:
SYJUJRIXXDRSBN-UHFFFAOYSA-N
SMILES:
OOc1ccc(cc1)S(=O)(=O)N
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.01g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
189.185g/mol
Monoisotopic Mass:
189.01g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
98A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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