Structure Info
- Chemspace ID
- CSMB00133016936 (Enamine MADE)
- CAS
- 1149677-57-5
- MFCD
- MFCD16621529
- IUPAC Name
- methyl (3S)-3-amino-4,4,4-trifluorobutanoate hydrochloride
- Mol formula
- C5H9ClF3NO2
- Mol weight
- 208 Da
- Catalog Number(s)
- CSC133016936, EN300-6731352, sh-70615
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.25
- Heavy atoms count
- 12
- Rotatable bond count
- 4
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.8
- Polar surface area (Å)
- 52
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00133016936
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