Cas no 778649-20-0 (1,8-Bis(bromoethynyl)anthracene)

1,8-Bis(bromoethynyl)anthracene structure
778649-20-0 structure
Product Name:1,8-Bis(bromoethynyl)anthracene
CAS No:778649-20-0
MF:C18H8Br2
MW:384.064123153687
CID:2801914
PubChem ID:71401703
Update Time:2025-04-21

1,8-Bis(bromoethynyl)anthracene Chemical and Physical Properties

Names and Identifiers

    • 778649-20-0
    • 1,8-Bis(bromoethynyl)anthracene
    • DTXSID20822726
    • Inchi: 1S/C18H8Br2/c19-9-7-13-3-1-5-15-11-16-6-2-4-14(8-10-20)18(16)12-17(13)15/h1-6,11-12H
    • InChI Key: WFUROLPAVDZASM-UHFFFAOYSA-N
    • SMILES: BrC#CC1=CC=CC2=CC3C=CC=C(C#CBr)C=3C=C21

Computed Properties

  • Exact Mass: 383.89723Da
  • Monoisotopic Mass: 381.89928Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 2
  • Complexity: 439
  • 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: 7
  • Topological Polar Surface Area: 0?2
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