Basic information
- CAS
66967-88-2- Standard SMILES
CC[N+](CC)(CC)Cc1ncccc1OC(=O)N(C)C.[Br-]- InChIKey
QMBGVIARFVVBJW-UHFFFAOYSA-M- Molecular formula
- C15H26BrN3O2
- Average molar mass
- 360.29 g/mol
- Monoisotopic mass
- 359.12084
Names & identifiers
- Preferred name
- Ammonium, ((3-hydroxy-2-pyridyl)methyl)triethyl-, bromide, dimethylcarbamate (ester)
- IUPAC
- [3-(dimethylcarbamoyloxy)-2-pyridinyl]methyl-triethylazanium bromide
Names & synonyms
66967-88-2Ro 2-24002-Pyridinemethanaminium, 3-(((dimethylamino)carbonyl)oxy)-N,N,N-triethyl-, bromideAmmonium, ((3-hydroxy-2-pyridyl)methyl)triethyl-, bromide, dimethylcarbamate (ester)((3-Hydroxy-2-pyridyl)methyl)triethylammonium bromide dimethylcarbamate (ester)RefChem:318630DTXSID80985720N-({3-[(dimethylcarbamoyl)oxy]pyridin-2-yl}methyl)-N,N-diethylethanaminium bromide
Database identifiers
- CAS
66967-88-2- PubChem CID
- 48667
- DTXSID
DTXSID80985720
Properties
Computed structural properties
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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