Cas no 76086-05-0 (ethyl ethoxymethyl ketone)

ethyl ethoxymethyl ketone structure
ethyl ethoxymethyl ketone structure
Product Name:ethyl ethoxymethyl ketone
CAS No:76086-05-0
MF:C6H12O2
MW:116.158282279968
CID:862175
PubChem ID:144750
Update Time:2025-04-19

ethyl ethoxymethyl ketone Chemical and Physical Properties

Names and Identifiers

    • ethyl ethoxymethyl ketone
    • 1-ethoxybutan-2-one
    • 2-butanone, 1-ethoxy-
    • 76086-05-0
    • 2-ethoxymethyl ethyl ketone
    • AKOS011315851
    • SCHEMBL5986397
    • DTXSID70226972
    • Inchi: 1S/C6H12O2/c1-3-6(7)5-8-4-2/h3-5H2,1-2H3
    • InChI Key: FRFMOVPIHHDDPP-UHFFFAOYSA-N
    • SMILES: O(CC)CC(CC)=O

Computed Properties

  • Exact Mass: 116.08376
  • Monoisotopic Mass: 116.083729621g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 4
  • Complexity: 68.9
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.7
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • PSA: 26.3
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