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CHEBI:1921 - 4-oxocyclohexanecarboxylic acid
| Formula | C7H10O3 |
| Net Charge | 0 |
| Average Mass | 142.154 |
| Monoisotopic Mass | 142.06299 |
| SMILES | O=C1CCC(C(=O)O)CC1 |
| InChI | InChI=1S/C7H10O3/c8-6-3-1-5(2-4-6)7(9)10/h5H,1-4H2,(H,9,10) |
| InChIKey | OWLXUYGCLDGHJJ-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-oxocyclohexanecarboxylic acid (CHEBI:1921) has functional parent cyclohexanecarboxylic acid (CHEBI:36096) |
| 4-oxocyclohexanecarboxylic acid (CHEBI:1921) has functional parent cyclohexanone (CHEBI:17854) |
| 4-oxocyclohexanecarboxylic acid (CHEBI:1921) is a 5-oxo monocarboxylic acid (CHEBI:35952) |
| 4-oxocyclohexanecarboxylic acid (CHEBI:1921) is a cyclohexanones (CHEBI:23482) |
| 4-oxocyclohexanecarboxylic acid (CHEBI:1921) is conjugate acid of 4-oxocyclohexanecarboxylate (CHEBI:15777) |
| Incoming Relation(s) |
| 4-oxocyclohex-2-ene-1-carboxylic acid (CHEBI:229775) has functional parent 4-oxocyclohexanecarboxylic acid (CHEBI:1921) |
| ethyl 4-oxocyclohexanecarboxylate (CHEBI:166505) has functional parent 4-oxocyclohexanecarboxylic acid (CHEBI:1921) |
| 4-oxocyclohexanecarboxylate (CHEBI:15777) is conjugate base of 4-oxocyclohexanecarboxylic acid (CHEBI:1921) |
| IUPAC Name |
|---|
| 4-oxocyclohexanecarboxylic acid |
| Synonyms | Source |
|---|---|
| 4-Ketocyclohexanecarboxylic acid | ChemIDplus |
| 1-cyclohexanone-4-carboxylic acid | ChEBI |
| cyclohexanone-4-carboxylic acid | ChEBI |
| Citations |
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