Ammonium, ((3-hydroxy-2-pyridyl)methyl)trimethyl-, bromide, dimethylcarbamate (ester)

HCID 48675

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Basic information

CAS: 66967-92-8
Standard SMILES: CN(C)C(=O)Oc1cccnc1C[N+](C)(C)C.[Br-]
InChIKey: RNWKAIUGROOQFF-UHFFFAOYSA-M
Molecular formula: C12H20BrN3O2
Average molar mass: 318.21 g/mol
Monoisotopic mass: 317.07389

Names & identifiers

Preferred name: Ammonium, ((3-hydroxy-2-pyridyl)methyl)trimethyl-, bromide, dimethylcarbamate (ester)
IUPAC: [3-(dimethylcarbamoyloxy)-2-pyridinyl]methyl-trimethylazanium bromide

Names & synonyms

66967-92-8Ro 2-1658Ammonium, ((3-hydroxy-2-pyridyl)methyl)trimethyl-, bromide, dimethylcarbamate (ester)((3-Hydroxy-2-pyridyl)methyl)trimethylammonium bromide dimethylcarbamate (ester)RefChem:318634DTXSID20985724{3-[(Dimethylcarbamoyl)oxy]pyridin-2-yl}-N,N,N-trimethylmethanaminium bromide

Database identifiers

CAS: 66967-92-8
PubChem CID: 48675
DTXSID: DTXSID20985724

Properties

Computed structural properties

Topological polar surface area: 42.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 4
Heavy atoms: 18
Formal charge: 0
Complexity: 261

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