Acetylsulfanilamide

C8H10N2O3SCAS 121-61-9214.24 g/mol

Open in Covalent MOL file
OHNSNH2OO
Sulfonamide

Properties

Molecular formula
C8H10N2O3S
Molar mass
214.24 g/mol
Exact mass
214.0412 Da
Melting point
219.5 °C
logP
0.94Crippen estimate
Polar surface area
92.8 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
121-61-9
SMILES
CC(O)=Nc1ccc(S(N)(=O)=O)cc1
InChIKey
PKOFBDHYTMYVGJ-UHFFFAOYSA-N
InChI
InChI=1S/C8H10N2O3S/c1-6(11)10-7-2-4-8(5-3-7)14(9,12)13/h2-5H,1H3,(H,10,11)(H2,9,12,13)

Weigh it out

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

Names and synonyms

21 names · show all
  • Sulfanilamide-N4-acetate
  • A-319
  • N-(4-Sulfamoylphenyl)acetamide
  • p-(Acetylamino)benzenesulfonamide
  • 4′-Sulfamoylacetanilide
  • N4-Acetsulfanilamide
  • 4-Acetylaminobenzenesulfonamide
  • 4-Acetamidobenzenesulfonamide
  • p-Sulfamoylacetanilide
  • N′-Acetylsulphanilamide
  • NSC 217
  • NSC 406839
  • Acetamide, N-[4-(aminosulfonyl)phenyl]-
  • Acetanilide, 4′-sulfamoyl-
  • N-[4-(Aminosulfonyl)phenyl]acetamide
  • N4-Acetylsulfanilamide
  • Neotherapol
  • p-Sulfamylacetanilide
  • Erytrin
  • p-Acetamidobenzenesulfonamide
  • Benzenesulfonamide, 4-(acetylamino)-

Work with Acetylsulfanilamide

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-[2-[4-(Aminosulfonyl)phenyl]ethyl]acetamide41472-49-562 % similar 4-Acetamidobenzenesulfonyl chloride121-60-861 % similar N,N'-Diacetyl-p-phenylenediamine140-50-159 % similar 4-Acetamidobenzenesulfonyl azide2158-14-754 % similar 4-Aminoacetanilide122-80-553 % similar 4′-Bromoacetanilide103-88-850 % similar 4-Methylacetanilide103-89-950 % similar Acetaminophen103-90-250 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Sulfacetamide144-80-9 Tosylurea1694-06-0 7-Aminodeacetoxycephalosporanic acid22252-43-3 7-Amino-3-methyl-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid26395-99-3 Ethyl 4-hydroxy-2-(methylsulfanyl)-5-pyrimidinecarboxylate53554-29-3 Ethyl 2-formamidothiazol-4-acetate64987-05-9 Diazald80-11-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook