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89244-12-2 | Benzenesulfonamide, N-[(4-chlorophenyl)sulfinyl]-4-methyl-
CAS No: 89244-12-2 Catalog No: AG00448K MDL No:
Product Description
Catalog Number:
AG00448K
Chemical Name:
Benzenesulfonamide, N-[(4-chlorophenyl)sulfinyl]-4-methyl-
CAS Number:
89244-12-2
Molecular Formula:
C13H12ClNO3S2
Molecular Weight:
329.8223
IUPAC Name:
N-(4-chlorophenyl)sulfinyl-4-methylbenzenesulfonamide
InChI:
InChI=1S/C13H12ClNO3S2/c1-10-2-8-13(9-3-10)20(17,18)15-19(16)12-6-4-11(14)5-7-12/h2-9,15H,1H3
InChI Key:
LNNRJNALAHSPGX-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)NS(=O)c1ccc(cc1)Cl
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.995g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
329.813g/mol
Monoisotopic Mass:
328.995g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
90.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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