4-(4-Carboxy-3-fluorophenyl)piperazine-1-carboxylic acid tert-butyl ester, 97%

cas: 1121596-45-9 — see every product listed under this CAS number, including other names

4-(4-Carboxy-3-fluorophenyl)piperazine-1-carboxylic acid tert-butyl ester, 97% (CAS 1121596-45-9) is a chemical reagent available from Chemat. Available pack sizes: 100mg, 250mg, 1g, 5g. Offered by: Chemat.

• 2D
• 3D

2-fluoro-4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]benzoic acid (CAS 1121596-45-9) is a chemical compound with the molecular formula C16H21FN2O4 and a molecular weight of 324.35 g/mol. IUPAC name: 2-fluoro-4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]benzoic acid. InChIKey: GMCDNRVWYLPHAM-UHFFFAOYSA-N.

Identity

Molecular formula	C16H21FN2O4
Molecular weight	324.35 g/mol
IUPAC name	2-fluoro-4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]benzoic acid
InChIKey	GMCDNRVWYLPHAM-UHFFFAOYSA-N
SMILES	CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=C(C=C2)C(=O)O)F

Computed by PubChem (NCBI)

Synonyms: 4-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-2-fluorobenzoic acid, 4-(4-Carboxy-3-fluoro-phenyl)-piperazine-1-carboxylic acid tert-butyl ester, 4-(4-Carboxy-3-fluorophenyl)-piperazine-1-carboxylic acid tert-butyl ester, 2-fluoro-4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]benzoic acid, 4-(4-Carboxy-3-fluorophenyl)piperazine-1-carboxylic acid tert-butyl ester, 4-{4-[(tert-butoxy)carbonyl]piperazin-1-yl}-2-fluorobenzoic acid, 4-[4-(tert-Butoxycarbonyl)piperazin-1-yl]-2-fluorobenzoic acid, 4-(4-Boc-1-piperazinyl)-2-fluorobenzoic Acid, 4-{4-Boc-piperazin-1-yl}-2-fluorobenzoic Acid, 4-(4-tert-butoxycarbonylpiperazin-1-yl)-2-fluoro-benzoic acid

Isomers (same molecular formula)

2-(2-fluorophenyl)-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]azetidin-1-yl]acetic acid C₁₆H₂₁FN₂O₄

tert-butyl N-[[3-(3-fluoro-4-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]carbamate C₁₆H₂₁FN₂O₄

3-fluoro-4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]benzoic acid C₁₆H₂₁FN₂O₄

Also listed as

4-[4-(tert-Butoxycarbonyl)piperazin-1-yl]-2-fluorobenzoic acid, 95% Combi-blocks CAS 1121596-45-9

4-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-2-fluorobenzoic acid, 98% Fluorochem CAS 1121596-45-9