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Arecoline-[d5] Hydrobromide Salt

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General Information
Catalog: BLP-010682
CAS: 131448-18-5
Molecular Formula: C8H9D5BrNO2
Molecular Weight: 241.14

Chemical Structure

Description	Arecoline-[d5] Hydrobromide Salt is the labelled salt of Arecoline, which is a muscarinic acetylcholine receptor agonist.
Synonyms	Arecoline D5 Hydrobromide Salt; 1,2,5,6-Tetrahydro-1-(methyl-d3)-3-pyridine-2,6-d2-carboxylic Acid, Methyl Ester Hydrobromide; 1-Methyl-1,2,5,6-tetrahydro-pyridine-3-carboxylic Acid-d5 Methyl Ester Hydrobromide; Arecaidine-d5 Methyl Ester Hydrobromide; Arecolin-d5 Hydrobromide; Methylarecaidine-d5 Hydrobromide; NSC 56321-d5 Hydrobromide
IUPAC Name	methyl 2,6-dideuterio-1-(trideuteriomethyl)-3,6-dihydro-2H-pyridine-5-carboxylate;hydrobromide
Related CAS	300-08-3 (unlabelled) 63-75-2 (unlabelled free base)
Isomeric SMILES	[2H]C1CC=C(C(N1C([2H])([2H])[2H])[2H])C(=O)OC.Br
Canonical SMILES	CN1CCC=C(C1)C(=O)OC.Br
InChI	InChI=1S/C8H13NO2.BrH/c1-9-5-3-4-7(6-9)8(10)11-2;/h4H,3,5-6H2,1-2H3;1H/i1D3,5D,6D;
InChI Key	AXOJRQLKMVSHHZ-UKYXHEKWSA-N
Melting Point	162-165°C
Purity	95%; ≥98% atom D
Solubility	Slightly soluble in DMSO, Methanol, Water
Appearance	White to Pale Beige Solid
Storage	Store at -20°C