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Home > Sulfanilamide > 84573-28-4
84573-28-4 | 4-methyl-N-[4-(4-methylphenyl)sulfonyloxyphenyl]benzenesulfonamide
CAS No: 84573-28-4 Catalog No: AG004R0I MDL No:
Product Description
Catalog Number:
AG004R0I
Chemical Name:
4-methyl-N-[4-(4-methylphenyl)sulfonyloxyphenyl]benzenesulfonamide
CAS Number:
84573-28-4
Molecular Formula:
C20H19NO5S2
Molecular Weight:
417.4986
IUPAC Name:
[4-[(4-methylphenyl)sulfonylamino]phenyl] 4-methylbenzenesulfonate
InChI:
InChI=1S/C20H19NO5S2/c1-15-3-11-19(12-4-15)27(22,23)21-17-7-9-18(10-8-17)26-28(24,25)20-13-5-16(2)6-14-20/h3-14,21H,1-2H3
InChI Key:
YTXFQAHNFQMZFY-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C
NSC Number:
105679
Properties
Complexity:
686
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
417.07g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
417.494g/mol
Monoisotopic Mass:
417.07g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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