Cas no 655-04-9 ( )

  structure
  structure
Product Name: 
CAS No:655-04-9
MF:C14H8O2
MW:208.21212387085
CID:961950
PubChem ID:101219
Update Time:2025-04-19

  Chemical and Physical Properties

Names and Identifiers

    • 1,2-Anthraquinone
    • 1,2-aminobenzimidazole
    • 1,2-Anthrachinon
    • 1,2-Diaminobenzimidazole
    • 1,2-Diamino-benzimidazole
    • 1.2-Dioxo-1.2-dihydro-anthracen
    • 1.2-Dioxo-anthracen-dihydrid-(1.2)
    • 1H-benzimidazole-1,2-diamine
    • AC1L8QI6
    • AE-848
    • Anthracen-1,2-dion
    • anthracene-1,2-dione
    • Anthrachinon-(1.2)
    • benzoimidazole-1,2-diamine
    • CHEMBL41060
    • Oprea1_843913
    • SureCN2952899
    • RGHILYZRVFRRNK-UHFFFAOYSA-N
    • NSC401140
    • 655-04-9
    • 1,2-DIHYDROANTHRACENE-1,2-DIONE
    • NSC-401140
    • Anthracenedione
    • 108121-76-2
    • NSC 401140
    • SCHEMBL1118356
    • 1,2-Anthracenedione
    • DTXSID00910630
    • UNII-C84TC3YC6C
    • C84TC3YC6C
    •  
    • Inchi: 1S/C14H8O2/c15-13-6-5-11-7-9-3-1-2-4-10(9)8-12(11)14(13)16/h1-8H
    • InChI Key: RGHILYZRVFRRNK-UHFFFAOYSA-N
    • SMILES: O=C1C(C=CC2=CC3C=CC=CC=3C=C21)=O

Computed Properties

  • Exact Mass: 208.05244
  • Monoisotopic Mass: 208.052
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 0
  • Complexity: 356
  • 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: 2.7
  • Topological Polar Surface Area: 34.1?2

Experimental Properties

  • Density: 1.328
  • Boiling Point: 404.3°Cat760mmHg
  • Flash Point: 170.9°C
  • Refractive Index: 1.702
  • PSA: 34.14
  • LogP: 2.61840
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