Cas no 870892-79-8 (2,7-Bis(9,9-dihexyl-9H-fluoren-2-yl)-9,9'-spirobi[fluorene])

2,7-Bis(9,9-dihexyl-9H-fluoren-2-yl)-9,9'-spirobi[fluorene] structure
870892-79-8 structure
Product Name:2,7-Bis(9,9-dihexyl-9H-fluoren-2-yl)-9,9'-spirobi[fluorene]
CAS No:870892-79-8
MF:C75H80
MW:981.437721252441
CID:2809801
PubChem ID:71405903
Update Time:2025-04-21

2,7-Bis(9,9-dihexyl-9H-fluoren-2-yl)-9,9'-spirobi[fluorene] Chemical and Physical Properties

Names and Identifiers

    • DTXSID80826528
    • 2,7-Bis(9,9-dihexyl-9H-fluoren-2-yl)-9,9'-spirobi[fluorene]
    • 870892-79-8
    • Inchi: 1S/C75H80/c1-5-9-13-25-45-73(46-26-14-10-6-2)65-33-21-17-29-57(65)61-41-37-53(49-69(61)73)55-39-43-63-64-44-40-56(52-72(64)75(71(63)51-55)67-35-23-19-31-59(67)60-32-20-24-36-68(60)75)54-38-42-62-58-30-18-22-34-66(58)74(70(62)50-54,47-27-15-11-7-3)48-28-16-12-8-4/h17-24,29-44,49-52H,5-16,25-28,45-48H2,1-4H3
    • InChI Key: RBMMZUOHPOBZDY-UHFFFAOYSA-N
    • SMILES: C1(C2C=CC=CC=2C2C=CC(C3=CC=C4C5C=CC(C6C=CC7C8C=CC=CC=8C(CCCCCC)(CCCCCC)C=7C=6)=CC=5C5(C6C=CC=CC=6C6=CC=CC=C56)C4=C3)=CC1=2)(CCCCCC)CCCCCC

Computed Properties

  • Exact Mass: 980.62600255Da
  • Monoisotopic Mass: 980.62600255Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 75
  • Rotatable Bond Count: 22
  • Complexity: 1600
  • 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: 25.5
  • Topological Polar Surface Area: 0?2
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