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Home > Sulfanilamide > 89819-32-9
89819-32-9 | 2H-1-Benzothiopyran-8-sulfonamide, 3,4-dihydro-4-oxo-
CAS No: 89819-32-9 Catalog No: AG003Z6C MDL No:
Product Description
Catalog Number:
AG003Z6C
Chemical Name:
2H-1-Benzothiopyran-8-sulfonamide, 3,4-dihydro-4-oxo-
CAS Number:
89819-32-9
Molecular Formula:
C9H9NO3S2
Molecular Weight:
243.3027
IUPAC Name:
4-oxo-2,3-dihydrothiochromene-8-sulfonamide
InChI:
InChI=1S/C9H9NO3S2/c10-15(12,13)8-3-1-2-6-7(11)4-5-14-9(6)8/h1-3H,4-5H2,(H2,10,12,13)
InChI Key:
COVRISQRCKQLCU-UHFFFAOYSA-N
SMILES:
O=C1CCSc2c1cccc2S(=O)(=O)N
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.002g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.295g/mol
Monoisotopic Mass:
243.002g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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