Basic information
- Standard SMILES
CC(O)C1(F)CCN(C(=O)OCc2ccccc2)C1- InChIKey
HNRGJNVEHLTNBK-UHFFFAOYSA-N- Molecular formula
- C14H18FNO3
- Average molar mass
- 267.3 g/mol
Names & identifiers
- Preferred name
- 3-Fluoro-3-(1-hydroxyethyl)pyrrolidine-1-carboxylic acid benzyl ester
- IUPAC
- benzyl 3-fluoro-3-(1-hydroxyethyl)pyrrolidine-1-carboxylate
Names & synonyms
SCHEMBL4519723HNRGJNVEHLTNBK-UHFFFAOYSA-N3-Fluoro-3-(1-hydroxyethyl)pyrrolidine-1-carboxylic acid benzyl ester
Database identifiers
- PubChem CID
- 69076779
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 320
Related reactions
6 records
Compound notes
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