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Loxapine-[d8] Hydrochloride

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General Information
Catalog: BLP-012420
CAS: 1246820-19-8
Molecular Formula: C18H11D8Cl2N3O
Molecular Weight: 372.32

Chemical Structure

Description	Loxapine-[d8] Hydrochloride is a labelled analogue of Loxapine. Loxapine is a typical antipsychotic used for the treatment of schizophrenia.
Synonyms	Loxapine-d8 Hydrochloride; 2-Chloro-11-[4-methyl(2H8)piperazin-1-yl]dibenzo[b,f][1,4]oxazepine-hydrogen chloride
IUPAC Name	8-chloro-6-(2,2,3,3,5,5,6,6-octadeuterio-4-methylpiperazin-1-yl)benzo[b][1,4]benzoxazepine;hydrochloride
Related CAS	54810-23-0 (unlabelled) 1189455-63-7 (free base)
Isomeric SMILES	[2H]C1(C(N(C(C(N1C)([2H])[2H])([2H])[2H])C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)Cl)([2H])[2H])[2H].Cl
Canonical SMILES	CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)Cl.Cl
InChI	InChI=1S/C18H18ClN3O.ClH/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18;/h2-7,12H,8-11H2,1H3;1H/i8D2,9D2,10D2,11D2;
InChI Key	JSXBVMKACNEMKY-KTSBLNPMSA-N
Melting Point	160-164°C
Purity	95% by HPLC; 95% atom D
Solubility	Soluble in Methanol, Water
Appearance	Off-white Solid
Storage	Store at -20°C, under inert atmosphere