Structure Info
- Chemspace ID
- CSMB00021136539 (Enamine MADE)
- CAS
- 2091448-64-3
- IUPAC Name
- ethyl 5-amino-2-chloro-3,4-difluorobenzoate
- Mol formula
- C9H8ClF2NO2
- Mol weight
- 236 Da
- Catalog Number(s)
- BBV-95884985, CSC021136539, EN300-27726025, FCH6994849
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.39
- Heavy atoms count
- 15
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 52
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00021136539
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