Basic information
- Standard SMILES
CCOC(=O)C1CCC[N+]1=c1sccs1- InChIKey
YEWAUVWVXQINBU-UHFFFAOYSA-N- Molecular formula
- C10H14NO2S2+
- Average molar mass
- 244.4 g/mol
Names & identifiers
- Preferred name
- Ethyl 1-(1,3-dithiol-2-ylidene)pyrrolidin-1-ium-2-carboxylate
- IUPAC
- ethyl 1-(1,3-dithiol-2-ylidene)pyrrolidin-1-ium-2-carboxylate
Names & synonyms
SCHEMBL10874242
Database identifiers
- PubChem CID
- 3064797
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 79.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 1
- Complexity
- 315
Related reactions
1 records
Compound notes
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