Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 5-chloro-1'-(2-methylpropyl)-, hydrochloride
Basic information
- CAS
83962-51-0- Standard SMILES
CC(C)CN1CCCC12OC(=S)c1cc(Cl)ccc12.Cl- InChIKey
RULSYIKJVKCSCR-UHFFFAOYSA-N- Molecular formula
- C15H19Cl2NOS
- Average molar mass
- 332.3 g/mol
- Monoisotopic mass
- 331.0564408
Names & identifiers
- Preferred name
- Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 5-chloro-1'-(2-methylpropyl)-, hydrochloride
- IUPAC
- 6-chloro-1'-(2-methylpropyl)spiro[2-benzofuran-3,2'-pyrrolidine]-1-thione;hydrochloride
Names & synonyms
Spiro(benzo(c)thiophene-1(3H),2'-pyrrolidin)-3-one, 5-chloro-1'-(2-methylpropyl)-, hydrochloride83962-51-0RefChem:380982DTXSID3010041895-Chloro-1'-(2-methylpropyl)-3H-spiro[[2]benzofuran-1,2'-pyrrolidine]-3-thione--hydrogen chloride (1/1)5-Chloro-1'-(2-methylpropyl)-3H-spiro[2-benzofuran-1,2'-pyrrolidine]-3-thione--hydrogen chloride (1/1)
Database identifiers
- CAS
83962-51-0- PubChem CID
- 3068892
- DTXSID
DTXSID301004189
Properties
Computed structural properties
- Topological polar surface area
- 44.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 375
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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