Cas no 114326-35-1 (7,14-dimethylbenzo[m]tetraphene-3,4-dione)

7,14-dimethylbenzo[m]tetraphene-3,4-dione structure
114326-35-1 structure
Product Name:7,14-dimethylbenzo[m]tetraphene-3,4-dione
CAS No:114326-35-1
MF:C24H16O2
MW:336.382646560669
CID:1202111
PubChem ID:188865
Update Time:2025-04-20

7,14-dimethylbenzo[m]tetraphene-3,4-dione Chemical and Physical Properties

Names and Identifiers

    • 7,14-dimethylbenzo[m]tetraphene-3,4-dione
    • DTXSID50150706
    • 114326-35-1
    • Dibenz(a,j)anthracene-3,4-dione, 7,14-dimethyl-
    • Inchi: 1S/C24H16O2/c1-13-16-8-7-15-5-3-4-6-18(15)22(16)14(2)23-17(13)9-10-20-19(23)11-12-21(25)24(20)26/h3-12H,1-2H3
    • InChI Key: JSZXYCIZBMYBCM-UHFFFAOYSA-N
    • SMILES: O=C1C(C=CC2=C1C=CC1=C(C)C3C=CC4C=CC=CC=4C=3C(C)=C12)=O

Computed Properties

  • Exact Mass: 336.11508
  • Monoisotopic Mass: 336.115029749g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 0
  • Complexity: 634
  • 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: 6
  • Topological Polar Surface Area: 34.1?2

Experimental Properties

  • PSA: 34.14
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