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Home > Sulfanilamide > 1671-20-1
1671-20-1 | 5-methanesulfonyl-2-methylbenzene-1-sulfonamide
CAS No: 1671-20-1 Catalog No: AG019UTC MDL No:MFCD11212970
Product Description
Catalog Number:
AG019UTC
Chemical Name:
5-methanesulfonyl-2-methylbenzene-1-sulfonamide
CAS Number:
1671-20-1
Molecular Formula:
C8H11NO4S2
Molecular Weight:
249.3072
MDL Number:
MFCD11212970
IUPAC Name:
2-methyl-5-methylsulfonylbenzenesulfonamide
InChI:
InChI=1S/C8H11NO4S2/c1-6-3-4-7(14(2,10)11)5-8(6)15(9,12)13/h3-5H,1-2H3,(H2,9,12,13)
InChI Key:
HOKCNQPJWCGBPW-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1S(=O)(=O)N)S(=O)(=O)C
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.013g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.299g/mol
Monoisotopic Mass:
249.013g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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