Structure Info
- Chemspace ID
- CSMB00005580511 (Enamine MADE)
- MFCD
- MFCD16133347
- IUPAC Name
- N-(1-cyanoethyl)-2-hydroxy-N,4-dimethylbenzamide
- Mol formula
- C12H14N2O2
- Mol weight
- 218 Da
- Catalog Number(s)
- BBV-33600319, CSC005580511, FCH769341
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.24
- Heavy atoms count
- 16
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.333
- Polar surface area (Å)
- 64
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00005580511
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