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Home > Sulfanilamide > 116436-08-9
116436-08-9 | 3-methyl-N-phenylbenzene-1-sulfonamide
CAS No: 116436-08-9 Catalog No: AG019OXX MDL No:MFCD00443821
Product Description
Catalog Number:
AG019OXX
Chemical Name:
3-methyl-N-phenylbenzene-1-sulfonamide
CAS Number:
116436-08-9
Molecular Formula:
C13H13NO2S
Molecular Weight:
247.3128
MDL Number:
MFCD00443821
IUPAC Name:
3-methyl-N-phenylbenzenesulfonamide
InChI:
InChI=1S/C13H13NO2S/c1-11-6-5-9-13(10-11)17(15,16)14-12-7-3-2-4-8-12/h2-10,14H,1H3
InChI Key:
DRAPBUPJVXGEEG-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)S(=O)(=O)Nc1ccccc1
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.067g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.312g/mol
Monoisotopic Mass:
247.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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