Cas no 6935-45-1 (Benzenesulfonamide,4-amino-N-(2-aminoethyl)-)

Benzenesulfonamide,4-amino-N-(2-aminoethyl)- structure
6935-45-1 structure
Product Name:Benzenesulfonamide,4-amino-N-(2-aminoethyl)-
CAS No:6935-45-1
MF:C8H13N3O2S
MW:215.272720098495
CID:522327
PubChem ID:238037
Update Time:2025-04-19

Benzenesulfonamide,4-amino-N-(2-aminoethyl)- Chemical and Physical Properties

Names and Identifiers

    • Benzenesulfonamide,4-amino-N-(2-aminoethyl)-
    • 4-amino-N-(2-aminoethyl)benzenesulfonamide
    • 6935-45-1
    • NCI60_003958
    • NCGC00013494
    • NSC-42167
    • CHEMBL1363331
    • SCHEMBL14628032
    • CCG-37884
    • EN300-5425955
    • NSC42167
    • NSC 42167
    • NCGC00096608-01
    • NCIStruc1_000389
    • NCIStruc2_000416
    • NCI42167
    • F21169
    • NCGC00013494-02
    • 4-amino-N-(2-aminoethyl)benzene-1-sulfonamide
    • DTXSID70285529
    • Inchi: 1S/C8H13N3O2S/c9-5-6-11-14(12,13)8-3-1-7(10)2-4-8/h1-4,11H,5-6,9-10H2
    • InChI Key: NBFKPKDIBNOBEP-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(=CC=1)N)(NCCN)(=O)=O

Computed Properties

  • Exact Mass: 215.07299
  • Monoisotopic Mass: 215.07284784g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 252
  • 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: -0.7
  • Topological Polar Surface Area: 107?2

Experimental Properties

  • PSA: 98.21
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