Cas no 3766-68-5 (Ethanone,1-(2,4,6-triethylphenyl)-)

Ethanone,1-(2,4,6-triethylphenyl)- structure
3766-68-5 structure
Product Name:Ethanone,1-(2,4,6-triethylphenyl)-
CAS No:3766-68-5
MF:C14H20O
MW:204.308004379272
CID:322811
PubChem ID:231768
Update Time:2025-04-19

Ethanone,1-(2,4,6-triethylphenyl)- Chemical and Physical Properties

Names and Identifiers

    • Ethanone,1-(2,4,6-triethylphenyl)-
    • 1-(2,4,6-triethylphenyl)ethanone
    • 2,4,6-Triethylacetophenon
    • NSC 28479
    • SCHEMBL18567675
    • 3766-68-5
    • NSC28479
    • DTXSID30282857
    • AKOS019064789
    • NSC-28479
    • Inchi: 1S/C14H20O/c1-5-11-8-12(6-2)14(10(4)15)13(7-3)9-11/h8-9H,5-7H2,1-4H3
    • InChI Key: PEJCAQNBGDDNHP-UHFFFAOYSA-N
    • SMILES: O=C(C)C1C(CC)=CC(CC)=CC=1CC

Computed Properties

  • Exact Mass: 204.15100
  • Monoisotopic Mass: 204.151
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 195
  • 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: 4
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • Density: 0.9475 g/cm3 (20 oC)
  • Boiling Point: 317.5°Cat760mmHg
  • Flash Point: 133°C
  • Refractive Index: 1.5097 (589.3 nm 20 oC)
  • Solubility: Very slightly soluble (0.13 g/l) (25 o C),
  • PSA: 17.07000
  • LogP: 3.57640

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