Cas no 69079-25-0 (1-benzyl-4-methylpyrrolidin-3-one)

1-benzyl-4-methylpyrrolidin-3-one structure
69079-25-0 structure
Product Name:1-benzyl-4-methylpyrrolidin-3-one
CAS No:69079-25-0
MF:C12H15NO
MW:189.253603219986
MDL:MFCD11858563
CID:973047
PubChem ID:12430980
Update Time:2025-04-19

1-benzyl-4-methylpyrrolidin-3-one Chemical and Physical Properties

Names and Identifiers

    • 1-benzyl-4-methylpyrrolidin-3-one
    • 3- Pyrrolidinone, 4-methyl-1-(phenylmethyl)-
    • 1-Benzyl-4-methyl-pyrrolidin-3-one
    • 69079-25-0
    • AKOS026728331
    • EN300-102419
    • NSXHIJHCRCPVAS-UHFFFAOYSA-N
    • 1-benzyl-4-methylpyrrolid-3-one
    • CS-0230131
    • 1-benzyl-4-methyl-3-pyrrolidone
    • SB38342
    • CHEMBL4578626
    • AMY15969
    • SCHEMBL9379752
    • DTXSID90497980
    • G55833
    • MDL: MFCD11858563
    • Inchi: 1S/C12H15NO/c1-10-7-13(9-12(10)14)8-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3
    • InChI Key: NSXHIJHCRCPVAS-UHFFFAOYSA-N
    • SMILES: O=C1CN(CC2C=CC=CC=2)CC1C

Computed Properties

  • Exact Mass: 189.115364102g/mol
  • Monoisotopic Mass: 189.115364102g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 208
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.9
  • Topological Polar Surface Area: 20.3?2

1-benzyl-4-methylpyrrolidin-3-one Pricemore >>

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