Cas no 4510-37-6 (1-(2,3-Dimethyloxiranyl)ethanone)

1-(2,3-Dimethyloxiranyl)ethanone structure
4510-37-6 structure
Product Name:1-(2,3-Dimethyloxiranyl)ethanone
CAS No:4510-37-6
MF:C6H10O2
MW:114.142402172089
CID:2856136
PubChem ID:12231415
Update Time:2025-04-21

1-(2,3-Dimethyloxiranyl)ethanone Chemical and Physical Properties

Names and Identifiers

    • SCHEMBL15341640
    • trans-2,3-dimethyl-2-acetyloxirane
    • 1-(2,3-Dimethyloxiranyl)ethanone
    • 4510-37-6
    • DTXSID301301456
    • Inchi: 1S/C6H10O2/c1-4(7)6(3)5(2)8-6/h5H,1-3H3
    • InChI Key: RZTHFMYLFRPNKG-UHFFFAOYSA-N
    • SMILES: O1C(C)C1(C(C)=O)C

Computed Properties

  • Exact Mass: 114.068079557Da
  • Monoisotopic Mass: 114.068079557Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 1
  • Complexity: 130
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.3
  • Topological Polar Surface Area: 29.6?2

1-(2,3-Dimethyloxiranyl)ethanone Related Literature

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