Cas no 22225-63-4 (9,10-Anthracenedione,1-hydroxy-3-methoxy-6-methyl-)

9,10-Anthracenedione,1-hydroxy-3-methoxy-6-methyl- structure
22225-63-4 structure
Product Name:9,10-Anthracenedione,1-hydroxy-3-methoxy-6-methyl-
CAS No:22225-63-4
MF:C16H12O4
MW:268.264084815979
CID:262526
PubChem ID:179389
Update Time:2025-04-19

9,10-Anthracenedione,1-hydroxy-3-methoxy-6-methyl- Chemical and Physical Properties

Names and Identifiers

    • 9,10-Anthracenedione,1-hydroxy-3-methoxy-6-methyl-
    • 1-hydroxy-3-methoxy-6-methylanthracene-9,10-dione
    • 1-Hydroxy-3-methoxy-6-methylanthra-9,10-quinone
    • 1-Hydroxy-3-methoxy-6-methylanthraquinone
    • 1-Hydroxy-3-methoxy-6-methylanthra-9,10-quinone #
    • Anthraquinone, 1-hydroxy-3-methoxy-6-methyl-
    • SCHEMBL16225959
    • DTXSID90176768
    • 2-Methylxanthopurpurin-7-methyl ether
    • 9,10-Anthracenedione, 1-hydroxy-3-methoxy-6-methyl-
    • IBTIVMOKTOHUFA-UHFFFAOYSA-N
    • UNII-00K6NHA51A
    • 22225-63-4
    • Q27231351
    • 00K6NHA51A
    • 6-Methylxanthopurpurin 3-methyl ether
    • Inchi: 1S/C16H12O4/c1-8-3-4-10-11(5-8)15(18)12-6-9(20-2)7-13(17)14(12)16(10)19/h3-7,17H,1-2H3
    • InChI Key: IBTIVMOKTOHUFA-UHFFFAOYSA-N
    • SMILES: O=C1C2C=C(C=C(C=2C(C2C=CC(C)=CC=21)=O)O)OC

Computed Properties

  • Exact Mass: 268.07356
  • Monoisotopic Mass: 268.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 1
  • Complexity: 419
  • 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: 3.4
  • Topological Polar Surface Area: 63.6?2

Experimental Properties

  • PSA: 63.6

9,10-Anthracenedione,1-hydroxy-3-methoxy-6-methyl- Related Literature

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