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94094-58-3 | N-(3-ACETYL-4-HYDROXY-PHENYL)BENZENESULFONAMIDE
CAS No: 94094-58-3 Catalog No: AG006S34 MDL No:
Product Description
Catalog Number:
AG006S34
Chemical Name:
N-(3-ACETYL-4-HYDROXY-PHENYL)BENZENESULFONAMIDE
CAS Number:
94094-58-3
Molecular Formula:
C14H13NO4S
Molecular Weight:
291.3223
IUPAC Name:
N-(3-acetyl-4-hydroxyphenyl)benzenesulfonamide
InChI:
InChI=1S/C14H13NO4S/c1-10(16)13-9-11(7-8-14(13)17)15-20(18,19)12-5-3-2-4-6-12/h2-9,15,17H,1H3
InChI Key:
RHTBRALULSRRQX-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc(ccc1O)NS(=O)(=O)c1ccccc1
EC Number:
302-161-5
Properties
Complexity:
437
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.057g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
291.321g/mol
Monoisotopic Mass:
291.057g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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