5-Phenyl-1,3-pentadiyne

Base Information

• Chemical Name: 5-Phenyl-1,3-pentadiyne
• CAS No.: 41268-41-1
• Molecular Formula: C11H8
• Molecular Weight: 140.185
• DSSTox Substance ID: DTXSID801313565
• Nikkaji Number: J1.520.610A
• Wikidata: Q27155229
• Metabolomics Workbench ID: 45805
• Mol file: 41268-41-1.mol

Synonyms:5-Phenyl-1,3-pentadiyne;penta-2,4-diynylbenzene;41268-41-1;Benzyldiacetylene;2,4-Pentadiynylbenzene #;Benzene, 2,4-pentadiynyl-;penta-2,4-diyn-1-ylbenzene;2,4-Pentadiynylbenzene, 9CI;CHEBI:81290;DTXSID801313565;C17717;Q27155229

Chemical Property of 5-Phenyl-1,3-pentadiyne

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 140.062600255
• Heavy Atom Count: 11
• Complexity: 208

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C#CC#CCC1=CC=CC=C1