Basic information
- CAS
58982-96-0- Standard SMILES
S=C1CCCN1c1ccccc1- InChIKey
UQJCXIUXTZEXCC-UHFFFAOYSA-N- Molecular formula
- C10H11NS
- Average molar mass
- 177.27 g/mol
- Monoisotopic mass
- 177.06122053
Names & identifiers
- Preferred name
- 1-Phenylpyrrolidine-2-thione
- IUPAC
- 1-phenylpyrrolidine-2-thione
Names & synonyms
1-phenylpyrrolidine-2-thione2-Pyrrolidinethione, 1-phenyl-58982-96-0SCHEMBL44262131-Phenyl-2-pyrrolidinethione #DTXSID20344953UQJCXIUXTZEXCC-UHFFFAOYSA-NHMS1578A22CCG-2173STK386231AKOS005431034ST50877053
Database identifiers
- CAS
58982-96-0- PubChem CID
- 600677
- DTXSID
DTXSID20344953- Nikkaji
- J796.610E
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 173
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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