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96803-90-6 | 4-HYDROXY-1-BENZOTHIOPHENE-2-SULFONAMIDE
CAS No: 96803-90-6 Catalog No: AG01BQF0 MDL No:MFCD25969640
Product Description
Catalog Number:
AG01BQF0
Chemical Name:
4-HYDROXY-1-BENZOTHIOPHENE-2-SULFONAMIDE
CAS Number:
96803-90-6
Molecular Formula:
C8H7NO3S2
Molecular Weight:
229.2761
MDL Number:
MFCD25969640
IUPAC Name:
4-hydroxy-1-benzothiophene-2-sulfonamide
InChI:
InChI=1S/C8H7NO3S2/c9-14(11,12)8-4-5-6(10)2-1-3-7(5)13-8/h1-4,10H,(H2,9,11,12)
InChI Key:
KWNKEEZVYAHKNV-UHFFFAOYSA-N
SMILES:
Oc1cccc2c1cc(s2)S(=O)(=O)N
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.987g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
229.268g/mol
Monoisotopic Mass:
228.987g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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