Structure Info
- Chemspace ID
- CSCS00135265811 (Synthesis)
- IUPAC Name
- 2-(2-amino-5-cyano-4-fluorophenyl)acetic acid
- Mol formula
- C9H7FN2O2
- Mol weight
- 194 Da
- Catalog Number(s)
- BBV-148338231, CSC135265811, FCH20010946
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.78
- Heavy atoms count
- 14
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.11111111111111
- Polar surface area (Å)
- 87
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSCS00135265811
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