Basic information
- CAS
340268-55-5- Standard SMILES
CCC1(O)CC(OC)c2c1cc[nH]c2=O- InChIKey
TVKJWORHZPZPKV-UHFFFAOYSA-N- Molecular formula
- C11H15NO3
- Average molar mass
- 209.24 g/mol
- Monoisotopic mass
- 209.10519334
Names & identifiers
- Preferred name
- 5-ethyl-5-hydroxy-7-methoxy-6,7-dihydro-2H-cyclopenta[c]pyridin-1-one
- IUPAC
- 5-ethyl-5-hydroxy-7-methoxy-6,7-dihydro-2H-cyclopenta[c]pyridin-1-one
- English name
- 1H-Cyclopenta[c]pyridin-1-one,5-ethyl-2,5,6,7-tetrahydro-5-hydroxy-7-methoxy-(9CI)
- Molecular formula
- C11H15NO3
- Molecular weight
- 209.2417
Names & synonyms
SCHEMBL67827871H-Cyclopenta[c]pyridin-1-one,5-ethyl-2,5,6,7-tetrahydro-5-hydroxy-7-methoxy-(9CI)
Database identifiers
- CAS
340268-55-5- PubChem CID
- 22745059
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 359
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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