Basic information
- CAS
847644-87-5- Standard SMILES
COC(=O)[C@@H](N)CC(F)F.Cl- InChIKey
LTLMGMDHRNVCAJ-DFWYDOINSA-N- Molecular formula
- C5H10ClF2NO2
- Average molar mass
- 189.59 g/mol
- Monoisotopic mass
- 189.0368126
Names & identifiers
- Preferred name
- methyl (2S)-2-amino-4,4-difluorobutanoate;hydrochloride
- IUPAC
- methyl (2S)-2-amino-4,4-difluorobutanoate;hydrochloride
Database identifiers
- CAS
847644-87-5- PubChem CID
- 175652723
Properties
Computed structural properties
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 118
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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