Ethyl 7-oxohept-2-enoate

Base Information

• Chemical Name: Ethyl 7-oxohept-2-enoate
• CAS No.: 67081-18-9
• Molecular Formula: C9H14O3
• Molecular Weight: 170.208
• DSSTox Substance ID: DTXSID20411634

Synonyms:Ethyl 7-oxohept-2-enoate;67081-18-9;2-Heptenoic acid, 7-oxo-, ethyl ester, (2E)-;DTXSID20411634

Chemical Property of Ethyl 7-oxohept-2-enoate

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 170.094294304
• Heavy Atom Count: 12
• Complexity: 161

Purity/Quality:

99% ^*data from raw suppliers

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• Canonical SMILES: CCOC(=O)C=CCCCC=O

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