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139363-01-2 | Benzenesulfonamide, N-[(hydroxyamino)iminomethyl]-4-methyl-
CAS No: 139363-01-2 Catalog No: AG001AVX MDL No:
Product Description
Catalog Number:
AG001AVX
Chemical Name:
Benzenesulfonamide, N-[(hydroxyamino)iminomethyl]-4-methyl-
CAS Number:
139363-01-2
Molecular Formula:
C8H11N3O3S
Molecular Weight:
229.2562
IUPAC Name:
N-(hydroxyamino)-N'-(4-methylphenyl)sulfonylmethanimidamide
InChI:
InChI=1S/C8H11N3O3S/c1-7-2-4-8(5-3-7)15(13,14)10-6-9-11-12/h2-6,11-12H,1H3,(H,9,10)
InChI Key:
QKBHTHQMFATMBB-UHFFFAOYSA-N
SMILES:
ONN=CNS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.052g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
229.254g/mol
Monoisotopic Mass:
229.052g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
99.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.6
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