tert-Butyl cetirizine

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Catalog Number

ACM335017464

Product Name

tert-Butyl cetirizine

Structure

CAS

335017-46-4

Category

Heterocyclic Organic Compound

Synonyms

[2-[4-[(4-Chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]-acetic Acid 1,1-Dimethylethyl Ester;

IUPAC Name

tert-butyl 2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]acetate

Molecular Weight

444.99

Molecular Formula

C₂₅H₃₃ClN₂O₃

Canonical SMILES

CC(C)(C)OC(=O)COCCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI Key

CRBIKYGPQWQMAG-UHFFFAOYSA-N

Boiling Point

533.823ºC at 760 mmHg

Flash Point

276.646ºC

Density

1.143g/cm³

Appearance

Light-Yellow Oil

Exact Mass

444.21800

H-Bond Acceptor

H-Bond Donor

MSDS

COA

Spec Sheet

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