Cas no 649765-04-8 (Anthracene, 9,10-dibromo-2,6-bis(decyloxy)-)

Anthracene, 9,10-dibromo-2,6-bis(decyloxy)- structure
649765-04-8 structure
Product Name:Anthracene, 9,10-dibromo-2,6-bis(decyloxy)-
CAS No:649765-04-8
MF:C34H48Br2O2
MW:648.551729202271
CID:409775
PubChem ID:71377576
Update Time:2025-04-19

Anthracene, 9,10-dibromo-2,6-bis(decyloxy)- Chemical and Physical Properties

Names and Identifiers

    • Anthracene, 9,10-dibromo-2,6-bis(decyloxy)-
    • 9,10-dibromo-2,6-didecoxyanthracene
    • 9,10-DIBROMO-2,6-BIS(DECYLOXY)ANTHRACENE
    • DTXSID10800210
    • 649765-04-8
    • Inchi: 1S/C34H48Br2O2/c1-3-5-7-9-11-13-15-17-23-37-27-19-21-29-31(25-27)33(35)30-22-20-28(26-32(30)34(29)36)38-24-18-16-14-12-10-8-6-4-2/h19-22,25-26H,3-18,23-24H2,1-2H3
    • InChI Key: NSHUWSARUGWLLA-UHFFFAOYSA-N
    • SMILES: BrC1C2C=CC(=CC=2C(=C2C=CC(=CC2=1)OCCCCCCCCCC)Br)OCCCCCCCCCC

Computed Properties

  • Exact Mass: 646.20224
  • Monoisotopic Mass: 646.20211g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 38
  • Rotatable Bond Count: 20
  • Complexity: 537
  • 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: 14.7
  • Topological Polar Surface Area: 18.5?2

Experimental Properties

  • PSA: 18.46
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