Cas no 15542-96-8 (2,5-Pyrrolidinedione,1,3-dimethyl-)

2,5-Pyrrolidinedione,1,3-dimethyl- structure
15542-96-8 structure
Product Name:2,5-Pyrrolidinedione,1,3-dimethyl-
CAS No:15542-96-8
MF:C6H9NO2
MW:127.141161680222
CID:198126
PubChem ID:85866
Update Time:2025-04-19

2,5-Pyrrolidinedione,1,3-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • 2,5-Pyrrolidinedione,1,3-dimethyl-
    • 1,3-Dimethylpyrrolidine-2,5-dione
    • N-methyl-3-methylsuccinimide
    • 15542-96-8
    • 1,3-dimethyl-pyrrolidine-2,5-dione
    • NS00051397
    • 2,5-Pyrrolidinedione, N,3-dimethyl
    • NIXKACOKLPRDMY-UHFFFAOYSA-N
    • DTXSID40935206
    • SCHEMBL2021592
    • EINECS 239-591-7
    • Inchi: 1S/C6H9NO2/c1-4-3-5(8)7(2)6(4)9/h4H,3H2,1-2H3
    • InChI Key: NIXKACOKLPRDMY-UHFFFAOYSA-N
    • SMILES: O=C1C(C)CC(N1C)=O

Computed Properties

  • Exact Mass: 127.06337
  • Monoisotopic Mass: 127.063
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 164
  • 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
  • Surface Charge: 0
  • Tautomer Count: 4
  • XLogP3: -0.3
  • Topological Polar Surface Area: 37.4A^2

Experimental Properties

  • Density: 1.127
  • Boiling Point: 228.3°Cat760mmHg
  • Flash Point: 100.2°C
  • Refractive Index: 1.474
  • PSA: 37.38
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