Structure Info
- Chemspace ID
- CSMB03496567429 (Enamine MADE)
- CAS
- 135235-94-8
- IUPAC Name
- 4,4,4-trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid
- Mol formula
- C12H9F6NO3
- Mol weight
- 329 Da
- Catalog Number(s)
- BBV-391738799, EN300-28295259, Z56824279
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.7
- Heavy atoms count
- 22
- Rotatable bond count
- 6
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.333
- Polar surface area (Å)
- 66
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB03496567429
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