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Chemical structure of Cetirizine Impurity B dihydrochloride

GC62056

Cetirizine Impurity B dihydrochloride

Also known as 2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]acetic acid;dihydrochloride

Cetirizine Impurity B dihydrochloride is an impurity of Cetirizine dihydrochloride

ChemicalCAS1000690-91-4MW417.76FormulaC19H23Cl3N2O2
CAS number
1000690-91-4
Molecular weight
417.76
Formula
C19H23Cl3N2O2
Solubility
DMSO : 250 mg/mL (598·43 mM)
InChIKey
LSPZEDLYSAUAQV-UHFFFAOYSA-N
Catalogue number
GC62056
Brand
GLPBIO
Computed properties PubChem CID 68928581 · TPSA 43.8 Ų · H-bond donors 3 · H-bond acceptors 4
TPSA
43.8 Ų
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
26

SMILES C1CN(CCN1CC(=O)O)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl.Cl

Computed descriptors from PubChem (CID 68928581), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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