Cas no 1068149-94-9 ((5S)-1,5-dimethylpiperazin-2-one)

(5S)-1,5-dimethylpiperazin-2-one structure
1068149-94-9 structure
Product Name:(5S)-1,5-dimethylpiperazin-2-one
CAS No:1068149-94-9
MF:C6H12N2O
MW:128.17228
MDL:MFCD09878620
CID:833202
PubChem ID:44630614
Update Time:2024-11-03

(5S)-1,5-dimethylpiperazin-2-one Chemical and Physical Properties

Names and Identifiers

    • (S)-1,5-Dimethylpiperazin-2-one
    • Benzamide, 4-[[9-(1,1-dimethylethyl)-2-oxo-3-[4-(trifluoromethoxy)phenyl]-1
    • AG-C-78319
    • AK-38938
    • ANW-72447
    • CTK5J1573
    • MolPort-000-140-305
    • RL00292
    • (5S)-1,5-dimethylpiperazin-2-one
    • AKOS006312981
    • J-502358
    • 1068149-94-9
    • EN300-2987059
    • DTXSID20659973
    • P10819
    • AKOS005258756
    • CS-0002034
    • MDL: MFCD09878620
    • Inchi: InChI=1S/C6H12N2O/c1-5-4-8(2)6(9)3-7-5/h5,7H,3-4H2,1-2H3/t5-/m0/s1
    • InChI Key: TUXCFTFFNGQODI-YFKPBYRVSA-N
    • SMILES: C[C@H]1CN(C)C(=O)CN1

Computed Properties

  • Exact Mass: 128.09506
  • Monoisotopic Mass: 128.094963011g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 124
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.5
  • Topological Polar Surface Area: 32.3?2

Experimental Properties

  • Density: 0.985
  • Boiling Point: 243 oC
  • Flash Point: 101 oC
  • PSA: 32.34

(5S)-1,5-dimethylpiperazin-2-one Pricemore >>

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