Basic information
- Standard SMILES
C=CCOC(=O)N1CC(S)CC1COCCF- InChIKey
XTXCULKSIWHJEV-UHFFFAOYSA-N- Molecular formula
- C11H18FNO3S
- Average molar mass
- 263.33 g/mol
Names & identifiers
- Preferred name
- 1-Allyloxycarbonyl-2-(2-fluoroethyloxymethyl)-4-mercaptopyrrolidine
- IUPAC
- prop-2-enyl 2-(2-fluoroethoxymethyl)-4-sulfanylpyrrolidine-1-carboxylate
Names & synonyms
SCHEMBL9795032XTXCULKSIWHJEV-UHFFFAOYSA-N1-allyloxycarbonyl-2-(2-fluoroethyloxymethyl)-4-mercaptopyrrolidine
Database identifiers
- PubChem CID
- 19087068
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 39.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 265
Related reactions
3 records
Compound notes
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