Cas no 1619-28-9 (2-Cyclopenten-1-one,3-(1-methylethyl)-)

2-Cyclopenten-1-one,3-(1-methylethyl)- structure
1619-28-9 structure
Product Name:2-Cyclopenten-1-one,3-(1-methylethyl)-
CAS No:1619-28-9
MF:C8H12O
MW:124.180282592773
CID:209854
PubChem ID:557599
Update Time:2025-04-19

2-Cyclopenten-1-one,3-(1-methylethyl)- Chemical and Physical Properties

Names and Identifiers

    • 2-Cyclopenten-1-one,3-(1-methylethyl)-
    • 3-Isopropyl-2-cyclopenten-1-one
    • 2-Cyclopenten-1-one,3-isopropyl- (7CI,8CI)
    • 3-(1-Methylethyl)-2-cyclopenten-1-one
    • Tanacetophorone
    • 3-Isopropylcyclopent-2-en-1-one
    • 3-Isopropyl-2-cyclopenten-1-one #
    • 2-Cyclopenten-1-one, 3-(1-methylethyl)-
    • 3-propan-2-ylcyclopent-2-en-1-one
    • AKOS014508702
    • 1619-28-9
    • SCHEMBL1665112
    • 3-isopropylcyclopentenone
    • Inchi: 1S/C8H12O/c1-6(2)7-3-4-8(9)5-7/h5-6H,3-4H2,1-2H3
    • InChI Key: OGHGFNURIXNXEM-UHFFFAOYSA-N
    • SMILES: O=C1C=C(CC1)C(C)C

Computed Properties

  • Exact Mass: 124.08886
  • Monoisotopic Mass: 124.089
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 154
  • 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: 1.2
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • Density: 0.9378
  • Boiling Point: 214°C (estimate)
  • Refractive Index: 1.4788
  • PSA: 17.07
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