4-Ethynylpyrene

Base Information

• Chemical Name: 4-Ethynylpyrene
• CAS No.: 185506-23-4
• Molecular Formula: C18H10
• Molecular Weight: 226.277
• DSSTox Substance ID: DTXSID90708987
• Nikkaji Number: J806.660D
• Wikidata: Q82643653
• ChEMBL ID: CHEMBL1908231
• Mol file: 185506-23-4.mol

Synonyms:4-ethynylpyrene

Chemical Property of 4-Ethynylpyrene

Chemical Property:

• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 226.078250319
• Heavy Atom Count: 18
• Complexity: 373

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C#CC1=CC2=CC=CC3=C2C4=C(C=CC=C14)C=C3

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