Cas no 67656-29-5 (methylenetanshinquinone)

methylenetanshinquinone structure
methylenetanshinquinone structure
Product Name:methylenetanshinquinone
CAS No:67656-29-5
MF:C18H14O3
MW:278.301965236664
CID:966561
PubChem ID:105118
Update Time:2025-08-03

methylenetanshinquinone Chemical and Physical Properties

Names and Identifiers

    • methylenetanshinquinone
    • TANSHINQUINONE, METHYLENE-
    • FS-7566
    • DTXSID30987017
    • 1-Methyl-6-methylene-6,7,8,9-tetrahydrophenanthro[1,2-b]furan-10,11-dione #
    • AKOS040760555
    • SCHEMBL14417727
    • HY-126417
    • 1-Methyl-6-methylene-6,7,8,9-tetrahydrophenanthro[1,2-b]furan-10,11-dione
    • CS-0103687
    • 1-Methyl-6-methylidene-6,7,8,9-tetrahydrophenanthro[1,2-b]furan-10,11-dione
    • 67656-29-5
    • 1-methyl-6-methylidene-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione
    • QDFFAXSMLUUJSG-UHFFFAOYSA-N
    • Phenanthro(1,2-b)furan-10,11-dione, 6,7,8,9-tetrahydro-1-methyl-6-methylene-
    • 1-methyl-6-methylidene-7H,8H,9H-phenanthro[1,2-b]furan-10,11-dione
    • Inchi: 1S/C18H14O3/c1-9-4-3-5-12-11(9)6-7-13-15(12)17(20)16(19)14-10(2)8-21-18(13)14/h6-8H,1,3-5H2,2H3
    • InChI Key: QDFFAXSMLUUJSG-UHFFFAOYSA-N
    • SMILES: O1C=C(C)C2C(C(C3=C(C=CC4C(=C)CCCC=43)C1=2)=O)=O

Computed Properties

  • Exact Mass: 278.09400
  • Monoisotopic Mass: 278.094
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 0
  • Complexity: 509
  • 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
  • Topological Polar Surface Area: 47.3A^2
  • XLogP3: 3.3

Experimental Properties

  • Color/Form: Red powder
  • Density: 1.3
  • Boiling Point: 502.9°C at 760 mmHg
  • Flash Point: 248.6°C
  • Refractive Index: 1.639
  • PSA: 47.28000
  • LogP: 3.98350

methylenetanshinquinone Pricemore >>

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