Structure Info
- Chemspace ID
- CSCS00135307257 (Synthesis)
- IUPAC Name
- 6-methoxy-2-methyl-3-nitrobenzonitrile
- Mol formula
- C9H8N2O3
- Mol weight
- 192 Da
- Catalog Number(s)
- BBV-148400838, CSC135307257, FCH20052484
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.13
- Heavy atoms count
- 14
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 76
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00135307257
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