5-Hexenoic acid, 3-oxo-, methyl ester

Base Information

• Chemical Name: 5-Hexenoic acid, 3-oxo-, methyl ester
• CAS No.: 100636-39-3
• Molecular Formula: C₇H₁₀O₃
• Molecular Weight: 142.155
• DSSTox Substance ID: DTXSID50463989
• Nikkaji Number: J1.424.805F
• Wikidata: Q82289134
• Mol file: 100636-39-3.mol

Synonyms:5-Hexenoic acid, 3-oxo-, methyl ester;100636-39-3;SCHEMBL12136578;DTXSID50463989

Chemical Property of 5-Hexenoic acid, 3-oxo-, methyl ester

Chemical Property:

• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 142.062994177
• Heavy Atom Count: 10
• Complexity: 149

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CC(=O)CC=C

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