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Home > Sulfanilamide > 955903-90-9
955903-90-9 | 4-oxo-3,4-dihydro-2H-1-benzopyran-6-sulfonamide
CAS No: 955903-90-9 Catalog No: AG01A555 MDL No:MFCD21359821
Product Description
Catalog Number:
AG01A555
Chemical Name:
4-oxo-3,4-dihydro-2H-1-benzopyran-6-sulfonamide
CAS Number:
955903-90-9
Molecular Formula:
C9H9NO4S
Molecular Weight:
227.2371
MDL Number:
MFCD21359821
IUPAC Name:
4-oxo-2,3-dihydrochromene-6-sulfonamide
InChI:
InChI=1S/C9H9NO4S/c10-15(12,13)6-1-2-9-7(5-6)8(11)3-4-14-9/h1-2,5H,3-4H2,(H2,10,12,13)
InChI Key:
NUJKYUFXSULTMM-UHFFFAOYSA-N
SMILES:
O=C1CCOc2c1cc(cc2)S(=O)(=O)N
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.025g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.234g/mol
Monoisotopic Mass:
227.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
94.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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