Benzo(b)thiophene-3-methylamine, 5-bromo-N-(2-chloroethyl)-N-isopropyl-, hydrochloride
Basic information
- CAS
16584-08-0- Standard SMILES
CC(C)N(CCCl)Cc1csc2ccc(Br)cc12.Cl- InChIKey
NQXHBIHBKWFIHN-UHFFFAOYSA-N- Molecular formula
- C14H18BrCl2NS
- Average molar mass
- 383.2 g/mol
- Monoisotopic mass
- 380.97204
Names & identifiers
- Preferred name
- Benzo(b)thiophene-3-methylamine, 5-bromo-N-(2-chloroethyl)-N-isopropyl-, hydrochloride
- IUPAC
- N-[(5-bromo-1-benzothiophen-3-yl)methyl]-N-(2-chloroethyl)propan-2-amine;hydrochloride
Names & synonyms
Benzo(b)thiophene-3-methylamine, 5-bromo-N-(2-chloroethyl)-N-isopropyl-, hydrochloride5-Bromo-N-(2-chloroethyl)-N-isopropylbenzo(b)thiophene-3-methylamine hydrochloride16584-08-0DTXSID60168034Benzo(b)thiophene-3-methanamine, 5-bromo-N-(2-chloroethyl)-N-(1-methylethyl)-, hydrochlorideRefChem:326255DTXCID7090525N-[(5-Bromo-1-benzothiophen-3-yl)methyl]-N-(2-chloroethyl)propan-2-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
16584-08-0- PubChem CID
- 204550
- DTXSID
DTXSID60168034
Properties
Computed structural properties
- Topological polar surface area
- 31.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 264
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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