Cas no 17560-54-2 (4-chloro-2-acetamido-5-sulfamoylbenzoic acid)

4-chloro-2-acetamido-5-sulfamoylbenzoic acid structure
17560-54-2 structure
Product Name:4-chloro-2-acetamido-5-sulfamoylbenzoic acid
CAS No:17560-54-2
MF:C9H9ClN2O5S
MW:292.696160078049
CID:228197
PubChem ID:87153
Update Time:2025-04-19

4-chloro-2-acetamido-5-sulfamoylbenzoic acid Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,2-(acetylamino)-5-(aminosulfonyl)-4-chloro-
    • 2-(acetylamino)-5-(aminosulphonyl)-4-chlorobenzoic acid
    • 2-acetamido-4-chloro-5-sulfamoylbenzoic acid
    • 2-(acetylamino)-4-chloro-5-sulfamoylbenzoic acid
    • Einecs 241-540-9
    • 2-(Acetylamino)-4-chloro-5-(sulfamoyl)benzoic acid
    • 2-(Acetylamino)-5-(aminosulfonyl)-4-chlorobenzoic acid
    • 4-chloro-2-acetamido-5-sulfamoylbenzoic acid
    • UNII-24G2S82BCD
    • 17560-54-2
    • 24G2S82BCD
    • EN300-18737925
    • SCHEMBL10721376
    • DTXSID50170005
    • Benzoic acid, 2-(acetylamino)-5-(aminosulfonyl)-4-chloro-
    • NS00025761
    • N-ACETYL-4-CHLORO-5-SULFAMOYLANTHRANILIC ACID
    • FT-0765648
    • Inchi: 1S/C9H9ClN2O5S/c1-4(13)12-7-3-6(10)8(18(11,16)17)2-5(7)9(14)15/h2-3H,1H3,(H,12,13)(H,14,15)(H2,11,16,17)
    • InChI Key: YUHXSVUWDBFINU-UHFFFAOYSA-N
    • SMILES: ClC1=CC(=C(C(=O)O)C=C1S(N)(=O)=O)NC(C)=O

Computed Properties

  • Exact Mass: 291.99217
  • Monoisotopic Mass: 291.9920703g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 446
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.4
  • Topological Polar Surface Area: 135?2

Experimental Properties

  • PSA: 126.56

4-chloro-2-acetamido-5-sulfamoylbenzoic acid Pricemore >>

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