Cas no 35623-12-2 (Benzoic acid, 3-[(methylamino)sulfonyl]-, hydrazide)

Benzoic acid, 3-[(methylamino)sulfonyl]-, hydrazide structure
35623-12-2 structure
Product Name:Benzoic acid, 3-[(methylamino)sulfonyl]-, hydrazide
CAS No:35623-12-2
MF:C8H11N3O3S
MW:229.256240129471
CID:1471826
PubChem ID:67751350
Update Time:2025-04-20

Benzoic acid, 3-[(methylamino)sulfonyl]-, hydrazide Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 3-[(methylamino)sulfonyl]-, hydrazide
    • 3-(hydrazinecarbonyl)-N-methylbenzenesulfonamide
    • NJKLZQRABVFDJP-UHFFFAOYSA-N
    • 3-(Hydrazinecarbonyl)-N-methylbenzene-1-sulfonamide
    • DTXSID00737622
    • SCHEMBL9024308
    • 35623-12-2
    • Inchi: 1S/C8H11N3O3S/c1-10-15(13,14)7-4-2-3-6(5-7)8(12)11-9/h2-5,10H,9H2,1H3,(H,11,12)
    • InChI Key: NJKLZQRABVFDJP-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=C(C(NN)=O)C=1)(NC)(=O)=O

Computed Properties

  • Exact Mass: 229.05223
  • Monoisotopic Mass: 229.05211239g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 323
  • 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: -0.6
  • Topological Polar Surface Area: 110?2

Experimental Properties

  • PSA: 101.29
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