Basic information
- Standard SMILES
CC(=O)S[C@H]1CNC(=O)C1- InChIKey
RCGMCMAJECIOHO-RXMQYKEDSA-N- Molecular formula
- C6H9NO2S
- Average molar mass
- 159.21 g/mol
Names & identifiers
- Preferred name
- (r)-4-Acetylthio-2-pyrrolidinone
- IUPAC
- S-[(3R)-5-oxopyrrolidin-3-yl] ethanethioate
Names & synonyms
(r)-4-acetylthio-2-pyrrolidinone142705-97-3S-[(3R)-5-oxopyrrolidin-3-yl] ethanethioateSCHEMBL4925483RCGMCMAJECIOHO-RXMQYKEDSA-N(4R)-4-Acetylthio-2-oxopyrrolidine(R)-4-acetylthio-2-oxo-pyrrolidinoneAKOS006279697
Database identifiers
- PubChem CID
- 10313245
- Nikkaji
- J1.230.333E
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 71.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 169
Related reactions
1 records
Compound notes
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