Ethyl 3-oxo-6-heptenoate
ethyl 3-oxohept-6-enoate
Also Known As: ethyl 3-oxohept-6-enoate|Ethyl 3-oxo-6-heptenoate|6-Heptenoic acid, 3-oxo-, ethyl ester|ethyl allylacetoacetate|ethyl3-oxohept-6-enoate|3-Oxo-6-heptenoic acid ethyl|ethyl 3-oxo-hept-6-enoate|3-oxo-6-Heptenoic acid ethyl ester|6-Heptenoic acid, ethyl ester|allylacetoacetic acid ethyl ester|3-Oxohept-6-enoic acid ethyl ester|3-oxo-hept-6-enoic acid ethyl ester|2-Oxo-5-hexene-1-carboxylic acid ethyl ester|631-504-4
CAS: 209-53-0
| Molecular Formula | C9H14O3 |
|---|---|
| Molecular Weight | 170.0943 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 170.0943 |
| Monoisotopic Mass | 170.0943 |
| Heavy Atoms | 12 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 209-53-0 |
|---|---|
| SMILES | CCOC(=O)CC(=O)CCC=C |
| InChIKey | BKXPKNYXXNYCBX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (70 patents)
Organic Building Blocks (3 patents)
Pharmaceutical Intermediates (79 patents)
Polymer Intermediates (18 patents)
Product Overview
Ethyl 3-oxo-6-heptenoate (CAS 209-53-0), with molecular formula C9H14O3 and molecular weight 170.0943 g/mol. IUPAC: ethyl 3-oxohept-6-enoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
Frequently Asked Questions
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