Structure Info
- Chemspace ID
- CSMB06863179191 (Enamine MADE)
- IUPAC Name
- methyl 2-chloro-4-fluoro-5-(methylamino)benzoate
- Mol formula
- C9H9ClFNO2
- Mol weight
- 218 Da
- Catalog Number(s)
- BBV-939601130, Z5640280377, s_38_20616052_7022558, s_38____20616052____7022558
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.2
- Heavy atoms count
- 14
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 38
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB06863179191
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