Structure Info
- Chemspace ID
- CSCS00020927837 (Synthesis)
- IUPAC Name
- ethyl 4-oxo-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrole-2-carboxylate
- Mol formula
- C12H15NO3
- Mol weight
- 221 Da
- Catalog Number(s)
- BBV-537638, CSC020927837, FCH5964107
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.85
- Heavy atoms count
- 16
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 59
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS00020927837
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