Basic information
- Standard SMILES
COC(=O)[C@@H](N)CC(C)(F)F.Cl- InChIKey
OFEAEMABDOXHOX-WCCKRBBISA-N- Molecular formula
- C6H12ClF2NO2
- Average molar mass
- 203.61 g/mol
Names & identifiers
- Preferred name
- methyl (S)-2-amino-4,4-difluoropentanoate hydrochloride
- IUPAC
- methyl (2S)-2-amino-4,4-difluoropentanoate;hydrochloride
Names & synonyms
methyl (S)-2-amino-4,4-difluoropentanoate hydrochlorideSCHEMBL345242
Database identifiers
- PubChem CID
- 86635604
Properties
Computed structural properties
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 150
Related reactions
6 records
Compound notes
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