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89244-11-1 | Benzenesulfonamide, 4-methyl-N-(phenylsulfinyl)-
CAS No: 89244-11-1 Catalog No: AG0042NH MDL No:
Product Description
Catalog Number:
AG0042NH
Chemical Name:
Benzenesulfonamide, 4-methyl-N-(phenylsulfinyl)-
CAS Number:
89244-11-1
Molecular Formula:
C13H13NO3S2
Molecular Weight:
295.3772
IUPAC Name:
N-(benzenesulfinyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C13H13NO3S2/c1-11-7-9-13(10-8-11)19(16,17)14-18(15)12-5-3-2-4-6-12/h2-10,14H,1H3
InChI Key:
HPSYJZOLBNPJSE-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)NS(=O)c1ccccc1
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.034g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
295.371g/mol
Monoisotopic Mass:
295.034g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
90.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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