Cas no 59222-14-9 (9,10-Anthracenedione, 1,2-bis(methylamino)-)

9,10-Anthracenedione, 1,2-bis(methylamino)- structure
59222-14-9 structure
Product Name:9,10-Anthracenedione, 1,2-bis(methylamino)-
CAS No:59222-14-9
MF:C16H14N2O2
MW:266.294563770294
CID:339442
PubChem ID:12262011
Update Time:2025-04-19

9,10-Anthracenedione, 1,2-bis(methylamino)- Chemical and Physical Properties

Names and Identifiers

    • 9,10-Anthracenedione, 1,2-bis(methylamino)-
    • 1,2-bis(methylamino)anthracene-9,10-dione
    • SCHEMBL18984661
    • bis(methylamino)anthraquinone
    • DTXSID90482937
    • 59222-14-9
    • Inchi: 1S/C16H14N2O2/c1-17-12-8-7-11-13(14(12)18-2)16(20)10-6-4-3-5-9(10)15(11)19/h3-8,17-18H,1-2H3
    • InChI Key: NRWJVAOAOUKRCS-UHFFFAOYSA-N
    • SMILES: O=C1C2C=CC=CC=2C(C2=CC=C(C(=C21)NC)NC)=O

Computed Properties

  • Exact Mass: 266.10562
  • Monoisotopic Mass: 266.105527694g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 2
  • Complexity: 409
  • 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: 58.2?2

Experimental Properties

  • PSA: 58.2

9,10-Anthracenedione, 1,2-bis(methylamino)- Related Literature

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