3,4,4-Trimethylpent-1-yne

Base Information

• Chemical Name: 3,4,4-Trimethylpent-1-yne
• CAS No.: 52763-16-3
• Molecular Formula: C8H14
• DSSTox Substance ID: DTXSID80502815
• Nikkaji Number: J1.256.061C

Synonyms:3,4,4-Trimethylpent-1-yne;52763-16-3;DTXSID80502815;EN300-1838641

Chemical Property of 3,4,4-Trimethylpent-1-yne

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 110.109550447
• Heavy Atom Count: 8
• Complexity: 106

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C#C)C(C)(C)C

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