Basic information
- CAS
18648-22-1- Standard SMILES
C[NH+](C)CCc1csc2ccccc12.[Cl-]- InChIKey
IEADCIRKURNNHE-UHFFFAOYSA-N- Molecular formula
- C12H16ClNS
- Average molar mass
- 241.78 g/mol
- Monoisotopic mass
- 241.0691984
Names & identifiers
- Preferred name
- Benzo(b)thiophene-3-ethylamine, N,N-dimethyl-, hydrochloride
- IUPAC
- 2-(1-benzothiophen-3-yl)ethyl-dimethylazanium chloride
Names & synonyms
BENZO(b)THIOPHENE-3-ETHYLAMINE, N,N-DIMETHYL-, HYDROCHLORIDE18648-22-1RefChem:1078830N,N-Dimethylbenzo(b)thiophene-3-ethylamine hydrochlorideN,N-Dimethyl-beta-3-aminoethylbenzothiophene hydrochloride
Database identifiers
- CAS
18648-22-1- PubChem CID
- 29181
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 181
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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