Basic information
- Standard SMILES
COC(=O)C(F)(C(=O)OC)[C@H]1C=CC[C@@H]1O- InChIKey
QQCYHMHYTRYYBA-BQBZGAKWSA-N- Molecular formula
- C10H13FO5
- Average molar mass
- 232.21 g/mol
Names & identifiers
- Preferred name
- dimethyl fluoro[(1S,5S)-5-hydroxycyclopent-2-en-1-yl]propanedioate
- IUPAC
- dimethyl 2-fluoro-2-[(1S,5S)-5-hydroxycyclopent-2-en-1-yl]propanedioate
Names & synonyms
SCHEMBL1417276QQCYHMHYTRYYBA-BQBZGAKWSA-Ndimethyl fluoro[(1S,5S)-5-hydroxycyclopent-2-en-1-yl]propanedioate
Database identifiers
- PubChem CID
- 44539494
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 309
Related reactions
1 records
Compound notes
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