Cas no 80475-26-9 (Ethanone, 1,1'-(1,2-dihydro-5,6-acenaphthylenediyl)bis-)

Ethanone, 1,1'-(1,2-dihydro-5,6-acenaphthylenediyl)bis- structure
80475-26-9 structure
Product Name:Ethanone, 1,1'-(1,2-dihydro-5,6-acenaphthylenediyl)bis-
CAS No:80475-26-9
MF:C16H14O2
MW:238.281164646149
CID:734208
PubChem ID:286393
Update Time:2025-04-19

Ethanone, 1,1'-(1,2-dihydro-5,6-acenaphthylenediyl)bis- Chemical and Physical Properties

Names and Identifiers

    • Ethanone, 1,1'-(1,2-dihydro-5,6-acenaphthylenediyl)bis-
    • 1-(6-acetyl-1,2-dihydroacenaphthylen-5-yl)ethanone
    • 5,6-Diacetyl-acenaphthen
    • 5,6-diacetyl-acenaphthene
    • 5,6-diacetylnaphthylene
    • 1,1'-(1,2-dihydroacenaphthylene-5,6-diyl)diethanone
    • DTXSID80301582
    • 80475-26-9
    • NSC-144485
    • NSC144485
    • SCHEMBL12363022
    • Inchi: 1S/C16H14O2/c1-9(17)13-7-5-11-3-4-12-6-8-14(10(2)18)16(13)15(11)12/h5-8H,3-4H2,1-2H3
    • InChI Key: WNZMHZZTZFNDHE-UHFFFAOYSA-N
    • SMILES: O=C(C)C1=CC=C2CCC3C=CC(C(C)=O)=C1C2=3

Computed Properties

  • Exact Mass: 238.09900
  • Monoisotopic Mass: 238.099
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 2
  • Complexity: 339
  • 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: 2.8
  • Topological Polar Surface Area: 34.1?2

Experimental Properties

  • Density: 1.203
  • Boiling Point: 449.5°Cat760mmHg
  • Flash Point: 167.5°C
  • Refractive Index: 1.644
  • PSA: 34.14000
  • LogP: 3.34360
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