Methyl 4-bromo-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenepropanoate

CAS Registry Number®

952729-66-7

CAS Name

Methyl 4-bromo-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenepropanoate

Molecular Formula

C15H20BrNO4

Molecular Mass

358.23

Cite this Page

Methyl 4-bromo-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenepropanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=952729-66-7 (retrieved 2025-01-22) (CAS RN: 952729-66-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H20BrNO4/c1-15(2,3)21-14(19)17-12(9-13(18)20-4)10-5-7-11(16)8-6-10/h5-8,12H,9H2,1-4H3,(H,17,19)

InChIKey

InChIKey=JPKABPHRXUGGJL-UHFFFAOYSA-N

SMILES

C(NC(OC(C)(C)C)=O)(CC(OC)=O)C1=CC=C(Br)C=C1

Canonical SMILES

O=C(OC(C)(C)C)NC(C1=CC=C(Br)C=C1)CC(=O)OC

Other Names for this Substance

  • Benzenepropanoic acid, 4-bromo-β-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester
  • Methyl 4-bromo-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenepropanoate
  • Methyl 3-(4-bromophenyl)-3-((tert-butoxycarbonyl)amino)propionate