2,2'-(Buta-1,3-diyne-1,4-diyl)bis(9,9-dihexyl-9H-fluorene)

Base Information

• Chemical Name: 2,2'-(Buta-1,3-diyne-1,4-diyl)bis(9,9-dihexyl-9H-fluorene)
• CAS No.: 827045-44-3
• Molecular Formula: C54H66
• DSSTox Substance ID: DTXSID30514584
• Wikidata: Q82374994

Synonyms:827045-44-3;DTXSID30514584;2,2'-(Buta-1,3-diyne-1,4-diyl)bis(9,9-dihexyl-9H-fluorene)

Chemical Property of 2,2'-(Buta-1,3-diyne-1,4-diyl)bis(9,9-dihexyl-9H-fluorene)

Chemical Property:

• XLogP3: 20.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 23
• Exact Mass: 714.516452105
• Heavy Atom Count: 54
• Complexity: 1110

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

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Useful:

• Canonical SMILES: CCCCCCC1(C2=CC=CC=C2C3=C1C=C(C=C3)C#CC#CC4=CC5=C(C=C4)C6=CC=CC=C6C5(CCCCCC)CCCCCC)CCCCCC

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