Structure Info
- Chemspace ID
- CSCS00033921241 (Synthesis)
- IUPAC Name
- 5-ethoxy-1,3-difluoro-2-isocyanatobenzene
- Mol formula
- C9H7F2NO2
- Mol weight
- 199 Da
- Catalog Number(s)
- BBV-107532784, CSC033921241, FCH7945327
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.37
- Heavy atoms count
- 14
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 39
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00033921241
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