Cas no 60184-76-1 (Benz[a]anthracene-7,12-dione, 11-methyl-)

Benz[a]anthracene-7,12-dione, 11-methyl- structure
60184-76-1 structure
Product Name:Benz[a]anthracene-7,12-dione, 11-methyl-
CAS No:60184-76-1
MF:C19H12O2
MW:272.297385215759
CID:498795
PubChem ID:13130520
Update Time:2025-04-19

Benz[a]anthracene-7,12-dione, 11-methyl- Chemical and Physical Properties

Names and Identifiers

    • Benz[a]anthracene-7,12-dione, 11-methyl-
    • 11-methylbenzo[a]anthracene-7,12-dione
    • Inchi: 1S/C19H12O2/c1-11-5-4-8-14-16(11)19(21)17-13-7-3-2-6-12(13)9-10-15(17)18(14)20/h2-10H,1H3
    • InChI Key: QUGGTIZGUJWIRD-UHFFFAOYSA-N
    • SMILES: O=C1C2C(C)=CC=CC=2C(C2C=CC3C=CC=CC=3C=21)=O

Computed Properties

  • Exact Mass: 272.08376
  • Monoisotopic Mass: 272.083729621g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 0
  • Complexity: 455
  • 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: 4.5
  • Topological Polar Surface Area: 34.1?2

Experimental Properties

  • PSA: 34.14
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