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Home > Sulfanilamide > 918161-76-9
918161-76-9 | Benzenesulfonamide, N-(3,5-diazido-4-hydroxyphenyl)-4-methyl-
CAS No: 918161-76-9 Catalog No: AG006LAC MDL No:
Product Description
Catalog Number:
AG006LAC
Chemical Name:
Benzenesulfonamide, N-(3,5-diazido-4-hydroxyphenyl)-4-methyl-
CAS Number:
918161-76-9
Molecular Formula:
C13H11N7O3S
Molecular Weight:
345.3365
IUPAC Name:
N-(3,5-diazido-4-hydroxyphenyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C13H11N7O3S/c1-8-2-4-10(5-3-8)24(22,23)18-9-6-11(16-19-14)13(21)12(7-9)17-20-15/h2-7,18,21H,1H3
InChI Key:
QCEDYRHZHKOUFP-UHFFFAOYSA-N
SMILES:
Oc1c(cc(cc1N=[N+]=[N-])NS(=O)(=O)c1ccc(cc1)C)N=[N+]=[N-]
Properties
Complexity:
600
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.064g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
345.337g/mol
Monoisotopic Mass:
345.064g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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