5-Hexynoic acid, 2-acetyl-, ethyl ester

Base Information

• Chemical Name: 5-Hexynoic acid, 2-acetyl-, ethyl ester
• CAS No.: 42809-56-3
• Molecular Formula: C₁₀H₁₄O₃
• Molecular Weight: 182.219
• DSSTox Substance ID: DTXSID401280017

Synonyms:DTXSID401280017;5-Hexynoic acid, 2-acetyl-, ethyl ester;42809-56-3

Chemical Property of 5-Hexynoic acid, 2-acetyl-, ethyl ester

Chemical Property:

• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 182.094294304
• Heavy Atom Count: 13
• Complexity: 234

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C(CCC#C)C(=O)C

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