Isoquinolinium, 1,2,3,4-tetrahydro-1,2-dimethyl-2-(3-(trimethylammonio)propyl)-, dibromide
Basic information
- CAS
64047-64-9- Standard SMILES
CC1c2ccccc2CC[N+]1(C)CCC[N+](C)(C)C.[Br-].[Br-]- InChIKey
OXCMEGSBLSWICP-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-1,2-dimethyl-2-(3-(trimethylammonio)propyl)-, dibromide
- IUPAC
- 3-(1,2-dimethyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)propyl-trimethylazanium dibromide
Names & synonyms
IN 32164047-64-9Isoquinolinium, 1,2,3,4-tetrahydro-1,2-dimethyl-2-(3-(trimethylammonio)propyl)-, dibromideAmmonium, (3-(1,2-dimethyl-1,2,3,4-tetrahydroisoquinolinio)propyl)trimethyl-, dibromideRefChem:350080DTXSID009822361,2-Dimethyl-2-[3-(trimethylazaniumyl)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium dibromide
Database identifiers
- CAS
64047-64-9- PubChem CID
- 46723
- DTXSID
DTXSID00982236
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 294
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Compound notes
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