Basic information
- CAS
5705-24-8- Standard SMILES
CCOC(=O)C1C(=O)CC(=O)CC1c1ccc(OC)cc1- InChIKey
QYKQFTVLQARPNH-UHFFFAOYSA-N- Molecular formula
- C16H18O5
- Average molar mass
- 290.31 g/mol
- Monoisotopic mass
- 290.11542367
Names & identifiers
- Preferred name
- AG-690/34034050
- IUPAC
- ethyl 2-(4-methoxyphenyl)-4,6-dioxocyclohexane-1-carboxylate
Names & synonyms
5705-24-8AG-690/34034050DTXSID00386432RefChem:317376DTXCID50337454ethyl 2-(4-methoxyphenyl)-4,6-dioxocyclohexane-1-carboxylateethyl 2-(4-methoxyphenyl)-4,6-dioxocyclohexanecarboxylateETHYL 2-(4-METHOXYPHENYL)-4,6-DIOXO-CYCLOHEXANE-1-CARBOXYLATEOprea1_698575Oprea1_849812AB00094085-01SR-01000217763
Show more names
SR-01000217763-1ethyl 6-(p-methoxyphenyl)-2,4-dioxocyclohexane-1-carboxylate
Database identifiers
- CAS
5705-24-8- PubChem CID
- 2862964
- DTXSID
DTXSID00386432
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 409
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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