Cas no 68214-75-5 (Benzoicacid, 2-[[(5-amino-2-methylphenyl)sulfonyl]amino]-)

Benzoicacid, 2-[[(5-amino-2-methylphenyl)sulfonyl]amino]- structure
68214-75-5 structure
Product Name:Benzoicacid, 2-[[(5-amino-2-methylphenyl)sulfonyl]amino]-
CAS No:68214-75-5
MF:C14H14N2O4S
MW:306.336962223053
CID:527755
PubChem ID:109791
Update Time:2025-04-19

Benzoicacid, 2-[[(5-amino-2-methylphenyl)sulfonyl]amino]- Chemical and Physical Properties

Names and Identifiers

    • Benzoicacid, 2-[[(5-amino-2-methylphenyl)sulfonyl]amino]-
    • 2-[(5-amino-2-methylphenyl)sulfonylamino]benzoic acid
    • 2-[[(5-amino-2-tolyl)sulphonyl]amino]benzoic acid
    • 2-(((5-Amino-2-tolyl)sulphonyl)amino)benzoic acid
    • 2-(5'-Amino-2'-methylbenzenesulphonamido)benzoic acid
    • 2-{[(5-amino-2-methylphenyl)sulfonyl]amino}benzoic acid
    • Benzoic acid, 2-(((5-amino-2-methylphenyl)sulfonyl)amino)-
    • 2-[[(5-Amino-2-tolyl)sulfonyl]amino]benzoic acid
    • Benzoic acid, 2-[[(5-amino-2-methylphenyl)sulfonyl]amino]-
    • DTXSID4071267
    • NS00036489
    • EINECS 269-315-0
    • 68214-75-5
    • Inchi： 1S/C14H14N2O4S/c1-9-6-7-10(15)8-13(9)21(19,20)16-12-5-3-2-4-11(12)14(17)18/h2-8,16H,15H2,1H3,(H,17,18)
    • InChI Key： XWVZYCCHMHNKOM-UHFFFAOYSA-N
    • SMILES： S(C1C=C(C=CC=1C)N)(NC1C=CC=CC=1C(=O)O)(=O)=O

Computed Properties

  • Exact Mass: 306.06752
  • Monoisotopic Mass: 306.067
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 4
  • Complexity: 474
  • 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: 2.2
  • Topological Polar Surface Area: 118?2

Experimental Properties

  • Density: 1.461
  • Boiling Point: 558.9°Cat760mmHg
  • Flash Point: 291.8°C
  • Refractive Index: 1.671
  • PSA: 109.49

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