tert-Butyl Cetirizine

cas: 335017-46-4 — see every product listed under this CAS number, including other names

tert-Butyl Cetirizine (CAS 335017-46-4) is a chemical reagent available from Chemat. Available pack sizes: 1g. Offered by: TRC.

brandTRC
catalog numberTRC-B690485-1G
cas335017-46-4
size1g
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Structural formula: {0} (CAS {1})

Tert-butyl 2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]acetate (CAS 335017-46-4) is a chemical compound with the molecular formula C25H33ClN2O3 and a molecular weight of 445.0 g/mol. IUPAC name: tert-butyl 2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]acetate. InChIKey: CRBIKYGPQWQMAG-UHFFFAOYSA-N.

Identity
Molecular formulaC25H33ClN2O3
Molecular weight445.0 g/mol
IUPAC nametert-butyl 2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]acetate
InChIKeyCRBIKYGPQWQMAG-UHFFFAOYSA-N
SMILESCC(C)(C)OC(=O)COCCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl

Computed by PubChem (NCBI)

Synonyms: tert-Butyl Cetirizine, tert-ButylCetirizine-d8, tert-Butyl(S)-Cetirizine, tert-butyl 2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]acetate, CRBIKYGPQWQMAG-UHFFFAOYSA-N, tert-Butyl (2-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}ethoxy)acetate
Isomers (same molecular formula)
butyl 4-[4-[(S)-(4-chlorophenyl)-pyridin-2-ylmethoxy]piperidin-1-yl]butanoate C25H33ClN2O3