Cas no 875574-51-9 (2,2'-(9,9-Dihexyl-9H-fluorene-2,7-diyl)di(9,9'-spirobi[fluorene]))

2,2'-(9,9-Dihexyl-9H-fluorene-2,7-diyl)di(9,9'-spirobi[fluorene]) structure
875574-51-9 structure
Product Name:2,2'-(9,9-Dihexyl-9H-fluorene-2,7-diyl)di(9,9'-spirobi[fluorene])
CAS No:875574-51-9
MF:C75H62
MW:963.294800281525
CID:2810278
PubChem ID:71405793
Update Time:2025-04-21

2,2'-(9,9-Dihexyl-9H-fluorene-2,7-diyl)di(9,9'-spirobi[fluorene]) Chemical and Physical Properties

Names and Identifiers

    • DTXSID20826426
    • 875574-51-9
    • 2,2'-(9,9-Dihexyl-9H-fluorene-2,7-diyl)di(9,9'-spirobi[fluorene])
    • Inchi: 1S/C75H62/c1-3-5-7-21-43-73(44-22-8-6-4-2)69-45-49(51-37-41-61-57-27-13-19-33-67(57)74(71(61)47-51)63-29-15-9-23-53(63)54-24-10-16-30-64(54)74)35-39-59(69)60-40-36-50(46-70(60)73)52-38-42-62-58-28-14-20-34-68(58)75(72(62)48-52)65-31-17-11-25-55(65)56-26-12-18-32-66(56)75/h9-20,23-42,45-48H,3-8,21-22,43-44H2,1-2H3
    • InChI Key: WTGYLPYFFQLHJJ-UHFFFAOYSA-N
    • SMILES: C1(CCCCCC)(CCCCCC)C2C=C(C=CC=2C2C=CC(C3=CC=C4C5C=CC=CC=5C5(C6C=CC=CC=6C6=CC=CC=C56)C4=C3)=CC1=2)C1=CC=C2C3C=CC=CC=3C3(C4C=CC=CC=4C4=CC=CC=C34)C2=C1

Computed Properties

  • Exact Mass: 962.485151978Da
  • Monoisotopic Mass: 962.485151978Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 75
  • Rotatable Bond Count: 12
  • Complexity: 1740
  • 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: 22
  • Topological Polar Surface Area: 0?2
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