Cas no 654683-40-6 (Pyrrolidine, 1-[(3-amino-2-hydroxyphenyl)sulfonyl]-)

Pyrrolidine, 1-[(3-amino-2-hydroxyphenyl)sulfonyl]- structure
654683-40-6 structure
Product Name:Pyrrolidine, 1-[(3-amino-2-hydroxyphenyl)sulfonyl]-
CAS No:654683-40-6
MF:C10H14N2O3S
MW:242.294761180878
CID:398675
PubChem ID:58736209
Update Time:2025-04-19

Pyrrolidine, 1-[(3-amino-2-hydroxyphenyl)sulfonyl]- Chemical and Physical Properties

Names and Identifiers

    • Pyrrolidine, 1-[(3-amino-2-hydroxyphenyl)sulfonyl]-
    • 2-amino-6-pyrrolidin-1-ylsulfonylphenol
    • SCHEMBL1121460
    • 2-Amino-6-(pyrrolidine-1-sulfonyl)phenol
    • DTXSID80729808
    • 2-Amino-6-(pyrrolidine-1-sulfonyl)-phenol
    • DSIKUUQKMFAMBX-UHFFFAOYSA-N
    • 654683-40-6
    • Inchi: 1S/C10H14N2O3S/c11-8-4-3-5-9(10(8)13)16(14,15)12-6-1-2-7-12/h3-5,13H,1-2,6-7,11H2
    • InChI Key: DSIKUUQKMFAMBX-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=C(C=1O)N)(N1CCCC1)(=O)=O

Computed Properties

  • Exact Mass: 242.07262
  • Monoisotopic Mass: 242.07251349g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 333
  • 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: 1.1
  • Topological Polar Surface Area: 92?2

Experimental Properties

  • PSA: 83.63
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