Cas no 659719-92-3 (Ketone, 2,4-dimethyl-3-thienyl methyl (5CI))

Ketone, 2,4-dimethyl-3-thienyl methyl (5CI) structure
659719-92-3 structure
Product Name:Ketone, 2,4-dimethyl-3-thienyl methyl (5CI)
CAS No:659719-92-3
MF:C8H10OS
MW:154.229401111603
CID:962872
PubChem ID:23129495
Update Time:2025-04-19

Ketone, 2,4-dimethyl-3-thienyl methyl (5CI) Chemical and Physical Properties

Names and Identifiers

    • Ketone, 2,4-dimethyl-3-thienyl methyl (5CI)
    • SCHEMBL10517601
    • DB-287837
    • 659719-92-3
    • KETONE, 2,4-DIMETHYL-3-THIENYL METHYL
    • Inchi: 1S/C8H10OS/c1-5-4-10-7(3)8(5)6(2)9/h4H,1-3H3
    • InChI Key: SUKAGUJHEYULJZ-UHFFFAOYSA-N
    • SMILES: S1C=C(C)C(C(C)=O)=C1C

Computed Properties

  • Exact Mass: 154.04523611g/mol
  • Monoisotopic Mass: 154.04523611g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 144
  • 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: 2.1
  • Topological Polar Surface Area: 45.3?2
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