Basic information
- CAS
50444-78-5- Standard SMILES
NC(F)(Cc1cnc[nH]1)C(=O)O- InChIKey
UNCJLBHXZSSWTD-UHFFFAOYSA-N- Molecular formula
- C6H8FN3O2
- Average molar mass
- 173.15 g/mol
- Monoisotopic mass
- 173.06005467
Names & identifiers
- Preferred name
- 2-amino-2-fluoro-3-(1H-imidazol-5-yl)propanoic acid
- IUPAC
- 2-amino-2-fluoro-3-(1H-imidazol-5-yl)propanoic acid
Names & synonyms
SCHEMBL20644246AKOS006285625
Database identifiers
- CAS
50444-78-5- PubChem CID
- 39670
Properties
Computed structural properties
- XLogP
- -3
- Topological polar surface area
- 92 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 190
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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