Cas no 62069-47-0 (2-Pyrrolidinone, 4-phenyl-, hydrochloride)

2-Pyrrolidinone, 4-phenyl-, hydrochloride structure
62069-47-0 structure
Product Name:2-Pyrrolidinone, 4-phenyl-, hydrochloride
CAS No:62069-47-0
MF:C10H12ClNO
MW:197.661381721497
CID:459138
PubChem ID:71390263
Update Time:2025-04-19

2-Pyrrolidinone, 4-phenyl-, hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 2-Pyrrolidinone, 4-phenyl-, hydrochloride
    • 4-phenylpyrrolidin-2-one,hydrochloride
    • 62069-47-0
    • 4-Phenylpyrrolidin-2-one--hydrogen chloride (1/1)
    • DTXSID40812184
    • Inchi: 1S/C10H11NO.ClH/c12-10-6-9(7-11-10)8-4-2-1-3-5-8;/h1-5,9H,6-7H2,(H,11,12);1H
    • InChI Key: IQCKZBBQSPKNHZ-UHFFFAOYSA-N
    • SMILES: Cl.O=C1CC(C2C=CC=CC=2)CN1

Computed Properties

  • Exact Mass: 197.06086
  • Monoisotopic Mass: 197.0607417g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 173
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 29.1?2

Experimental Properties

  • PSA: 29.1
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