Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CC[C@H](Oc2cccc(F)c2)C1- InChIKey
JOPSNIJFPWFSTK-ZDUSSCGKSA-N- Molecular formula
- C15H20FNO3
- Average molar mass
- 281.32 g/mol
- Monoisotopic mass
- 281.14272166
Names & identifiers
- Preferred name
- (S)-tert-butyl 3-(3-fluorophenoxy)pyrrolidine-1-carboxylate
- IUPAC
- tert-butyl (3S)-3-(3-fluorophenoxy)pyrrolidine-1-carboxylate
Names & synonyms
SCHEMBL9901530SCHEMBL23456337JOPSNIJFPWFSTK-ZDUSSCGKSA-N(S)-tert-butyl 3-(3-fluorophenoxy)pyrrolidine-1-carboxylate
Database identifiers
- PubChem CID
- 67958745
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 343
Related reactions
2 records
Compound notes
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