Ammonium, (2-hydroxyphenyl)trimethyl-, bromide, dimethylcarbamate (ester)

HCID 48665

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Basic information

CAS: 66967-87-1
Standard SMILES: CN(C)C(=O)Oc1ccccc1[N+](C)(C)C.[Br-]
InChIKey: YFNDHXKEDHTVOV-UHFFFAOYSA-M
Molecular formula: C12H19BrN2O2
Average molar mass: 303.2 g/mol
Monoisotopic mass: 302.06299

Names & identifiers

Preferred name: Ammonium, (2-hydroxyphenyl)trimethyl-, bromide, dimethylcarbamate (ester)
IUPAC: [2-(dimethylcarbamoyloxy)phenyl]-trimethylazanium bromide

Names & synonyms

Ro 2-092566967-87-1(2-Hydroxyphenyl)trimethylammonium bromide dimethylcarbamate (ester)AMMONIUM, (2-HYDROXYPHENYL)TRIMETHYL-, BROMIDE, DIMETHYLCARBAMATE (ester)RefChem:318815DTXSID709857192-[(DIMETHYLCARBAMOYL)OXY]-N,N,N-TRIMETHYLANILINIUM BROMIDE

Database identifiers

CAS: 66967-87-1
PubChem CID: 48665
DTXSID: DTXSID70985719

Properties

Computed structural properties

Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 17
Formal charge: 0
Complexity: 246

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