chempirical

N-(4-Hydroxyphenyl)benzenesulfonamide

C12H11NO3SCAS 5471-90-9249.28 g/mol

Open in Covalent MOL file
OSONHHO
PhenolSulfonamide

Properties

Molecular formula
C12H11NO3S
Molar mass
249.28 g/mol
Exact mass
249.0460 Da
Melting point
156 °C
logP
2.19Crippen estimate
Polar surface area
66.4 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
3

Identifiers

CAS number
5471-90-9
SMILES
O=S(=O)(Nc1ccc(O)cc1)c1ccccc1
InChIKey
WHZPMLXZOSFAKY-UHFFFAOYSA-N
InChI
InChI=1S/C12H11NO3S/c14-11-8-6-10(7-9-11)13-17(15,16)12-4-2-1-3-5-12/h1-9,13-14H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • Benzenesulfonamide, N-(4-hydroxyphenyl)-
  • Benzenesulfonanilide, 4′-hydroxy-
  • p-Benzenesulfonamido phenol
  • 4-Benzenesulfonamido phenol
  • NSC 28472

Work with N-(4-Hydroxyphenyl)benzenesulfonamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Phenylbenzenesulfonamide1678-25-771 % similar Piloty'S acid599-71-352 % similar 4,4′-Diaminobenzenesulfonanilide16803-97-752 % similar N-(Phenylsulfonyl)benzenesulfonamide2618-96-450 % similar 3-Amino-N-phenylbenzenesulfonamide80-21-750 % similar 4-Hydroxydiphenylamine122-37-248 % similar N-Methylbenzenesulfonamide5183-78-845 % similar Benzenesulfonyl hydrazide80-17-145 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Phenyl 2-aminobenzenesulfonate68227-69-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook