Cetirizine-[d8] Dihydrochloride

Datasheet MSDS
Catalog Number
ALP1546
Product Name
Cetirizine-[d8] Dihydrochloride
CAS Number
2070015-04-0
IUPAC Name
2-[2-[4-[(4-chlorophenyl)-phenylmethyl]-2,2,3,3,5,5,6,6-octadeuteriopiperazin-1-yl]ethoxy]acetic acid;dihydrochloride
Synonyms
Cetirizine-d8Dihydrochloride; 2-[4-[(4-Chlorophenyl)-phenylmethyl]-1-piperazinyl-d8]ethoxy]aceticAcidDihydrochloride
Molecular Formula
C21H17D8ClN2O3·2HCl
Molecular Weight
469.86
Appearance
White Solid
Purity
≥99%;≥99% atom D
Solubility
Slightly soluble in Methanol, Water
Melting Point
208-210°C
Storage
Store at -20°C, under inert atmosphere
SMILES
[2H]C1(C(N(C(C(N1CCOCC(=O)O)([2H])[2H])([2H])[2H])C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)([2H])[2H])[2H].Cl.Cl
InChI
InChI=1S/C21H25ClN2O3.2ClH/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26;;/h1-9,21H,10-16H2,(H,25,26);2*1H/i10D2,11D2,12D2,13D2;;
InChI Key
PGLIUCLTXOYQMV-FLZNRFFQSA-N
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