Quetiapine Hydroxy Impurity Dihydrochloride Salt

Analyte Name

2-[4-(Dibenzo[b,f][1,4]thiazepin-11-yl)piperazin-1-yl]ethanol dihydrochloride

CAS Number

329218-14-6

Molecular Formula

C19 H21 N3 O S . 2 Cl H

Molecular Weight

412.38

Accurate Mass

411.0939

SMILES

Cl.Cl.OCCN1CCN(CC1)C2=Nc3ccccc3Sc4ccccc24

InChI

InChI=1S/C19H21N3OS.2ClH/c23-14-13-21-9-11-22(12-10-21)19-15-5-1-3-7-17(15)24-18-8-4-2-6-16(18)20-19;;/h1-8,23H,9-14H2;2*1H

IUPAC

2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethanol;dihydrochloride

Alternate CAS Number

Free base: 329216-67-3

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Quetiapine Fumarate

Purity

>95% (HPLC)