Benzo(b)thiophene-3-methylamine, N-(2-chloroethyl)-N-ethyl-, hydrochloride
Basic information
- CAS
7349-45-3- Standard SMILES
CC[NH+](CCCl)Cc1csc2ccccc12.[Cl-]- InChIKey
SHJSEQUNRLPPOL-UHFFFAOYSA-N- Molecular formula
- C13H17Cl2NS
- Average molar mass
- 290.3 g/mol
- Monoisotopic mass
- 289.0458761
Names & identifiers
- Preferred name
- Benzo(b)thiophene-3-methylamine, N-(2-chloroethyl)-N-ethyl-, hydrochloride
- IUPAC
- 1-benzothiophen-3-ylmethyl-(2-chloroethyl)-ethylazanium chloride
Names & synonyms
NSC 84019BENZO(b)THIOPHENE-3-METHYLAMINE, N-(2-CHLOROETHYL)-N-ETHYL-, HYDROCHLORIDE7349-45-3N-(2-Chloroethyl)-N-ethylbenzo(b)thiophene-3-methylamine hydrochlorideBenzo(b)thiophene-3-methanamine, N-(2-chloroethyl)-N-ethyl-, hydrochlorideRefChem:326261Benzo(b)thiophene-3-methanamine, N-(2-chloroethyl)-N-ethyl-, hydrochloride (9CI)1-benzothiophen-3-ylmethyl-(2-chloroethyl)-ethylazanium;chloride
Database identifiers
- CAS
7349-45-3- PubChem CID
- 23790
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 212
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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