Basic information
- CAS
63742-19-8- Standard SMILES
CSN1C(=O)CCC1=O- InChIKey
ASMHRQPUVUEGBD-UHFFFAOYSA-N- Molecular formula
- C5H7NO2S
- Average molar mass
- 145.18 g/mol
- Monoisotopic mass
- 145.01974964
Names & identifiers
- Preferred name
- 1-(Methylsulfanyl)pyrrolidine-2,5-dione
- IUPAC
- 1-methylsulfanylpyrrolidine-2,5-dione
Names & synonyms
63742-19-81-(Methylsulfanyl)pyrrolidine-2,5-dioneDTXSID50315999RefChem:226812DTXCID10267122NSC298376SCHEMBL7761904NSC-298376
Database identifiers
- CAS
63742-19-8- PubChem CID
- 326693
- DTXSID
DTXSID50315999
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 141
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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