4-Ethynyl-6,6-dimethylocta-1,7-dien-4-ol

Base Information

• Chemical Name: 4-Ethynyl-6,6-dimethylocta-1,7-dien-4-ol
• CAS No.: 422324-02-5
• Molecular Formula: C₁₂H₁₈O
• Molecular Weight: 178.274
• DSSTox Substance ID: DTXSID90477202
• Nikkaji Number: J1.683.405J

Synonyms:422324-02-5;AGN-PC-0NHPVK;DTXSID90477202

Chemical Property of 4-Ethynyl-6,6-dimethylocta-1,7-dien-4-ol

Chemical Property:

• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 178.135765193
• Heavy Atom Count: 13
• Complexity: 241

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(CC(CC=C)(C#C)O)C=C

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