Isoquinolinium, 1,2,3,4-tetrahydro-2-ethyl-2-(3-(trimethylammonio)propyl)-, dibromide
Basic information
- CAS
64047-65-0- Standard SMILES
CC[N+]1(CCC[N+](C)(C)C)CCc2ccccc2C1.[Br-].[Br-]- InChIKey
LILHXRHKCXDQGU-UHFFFAOYSA-L- Molecular formula
- C17H30Br2N2
- Average molar mass
- 422.2 g/mol
- Monoisotopic mass
- 420.07757
Names & identifiers
- Preferred name
- Isoquinolinium, 1,2,3,4-tetrahydro-2-ethyl-2-(3-(trimethylammonio)propyl)-, dibromide
- IUPAC
- 3-(2-ethyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)propyl-trimethylazanium dibromide
Names & synonyms
IN 29264047-65-0Ammonium, (3-(2-ethyl-1,2,3,4-tetrahydroisoquinolinio)propyl)trimethyl-, dibromideIsoquinolinium, 1,2,3,4-tetrahydro-2-ethyl-2-(3-(trimethylammonio)propyl)-, dibromideRefChem:350081DTXSID609822372-Ethyl-2-[3-(trimethylazaniumyl)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium dibromide
Database identifiers
- CAS
64047-65-0- PubChem CID
- 46725
- DTXSID
DTXSID60982237
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 281
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…