Molecular properties
- Formula
- C11H12O5
- Molar mass
- 224.21 g·mol−1
- Exact mass
- 224.0685 Da
- 6
- PubChem CID
- 14371531
Molecule record
4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylic acid
C11H12O5
224.21 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Alkene
Carboxylic acid
Ketone
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 112ZF04MPX
- 143294-89-7
- 4-(Cyclopropyl(hydroxy)methylene)-3,5-dioxocyclohexanecarboxylic acid
- 4-[cyclopropyl(hydroxy)methylene]-3,5-dioxo-cyclohexanecarboxylic acid
- CHEBI:83454
- Cyclohexanecarboxylic acid, 4-(cyclopropylcarbonyl)-3,5-dioxo-
- Cyclohexanecarboxylic acid, 4-(cyclopropylhydroxymethylene)-3,5-dioxo-
- DTXSID90559517
Show all 24 synonyms
- E80362
- EEA27373
- MSK24002
- NS00004127
- NS00067849
- Q15632713
- SCHEMBL125835
- TFA29489
- Trinexapac
- Trinexapac (free acid)
- Trinexapac [ISO]
- Trinexapac acid
- Trinexapac-ethyl metabolite
- UNII-112ZF04MPX
- cimetacarb
- trinexapac-ethyl TP1
Structure identifiers
- Canonical SMILES
- O=C1CC(C(=O)O)CC(=O)C1=C(O)C1CC1
- Isomeric SMILES
- C1CC1C(=C2C(=O)CC(CC2=O)C(=O)O)O
- InChI
- InChI=1S/C11H12O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h5-6,14H,1-4H2,(H,15,16)
- InChIKey
- DFFWZNDCNBOKDI-UHFFFAOYSA-N
- PubChem CID
- 14371531
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylic acid; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 4-[cyclopropyl(hydroxy)methylidene]-3,5-dioxocyclohexane-1-carboxylic acid; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.