3-Chloro-2-[[(1,1-dimethylethoxy)carbonyl]amino]benzoic acid

CAS Registry Number®

616224-62-5
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CAS Name

3-Chloro-2-[[(1,1-dimethylethoxy)carbonyl]amino]benzoic acid

Molecular Formula

C12H14ClNO4

Molecular Mass

271.70

Cite this Page

3-Chloro-2-[[(1,1-dimethylethoxy)carbonyl]amino]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=616224-62-5 (retrieved 2024-08-08) (CAS RN: 616224-62-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H14ClNO4/c1-12(2,3)18-11(17)14-9-7(10(15)16)5-4-6-8(9)13/h4-6H,1-3H3,(H,14,17)(H,15,16)

InChIKey

InChIKey=MCTIHFBNQFRARW-UHFFFAOYSA-N

SMILES

N(C(OC(C)(C)C)=O)C1=C(C(O)=O)C=CC=C1Cl

Canonical SMILES

O=C(O)C=1C=CC=C(Cl)C1NC(=O)OC(C)(C)C

Other Names for this Substance

  • Benzoic acid, 3-chloro-2-[[(1,1-dimethylethoxy)carbonyl]amino]-
  • 3-Chloro-2-[[(1,1-dimethylethoxy)carbonyl]amino]benzoic acid
  • 2-(Boc)amino-3-chlorobenzoic acid
  • 2-((tert-Butoxycarbonyl)amino)-3-chlorobenzoic acid