3-Chloro-α-(4-nitrophenyl)benzenepropanoic acid

CAS Registry Number®

860610-54-4
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CAS Name

3-Chloro-α-(4-nitrophenyl)benzenepropanoic acid

Molecular Formula

C15H12ClNO4

Molecular Mass

305.71

Cite this Page

3-Chloro-α-(4-nitrophenyl)benzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=860610-54-4 (retrieved 2024-08-26) (CAS RN: 860610-54-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H12ClNO4/c16-12-3-1-2-10(8-12)9-14(15(18)19)11-4-6-13(7-5-11)17(20)21/h1-8,14H,9H2,(H,18,19)

InChIKey

InChIKey=ALPNDDLVTGIILM-UHFFFAOYSA-N

SMILES

C(CC1=CC(Cl)=CC=C1)(C(O)=O)C2=CC=C(N(=O)=O)C=C2

Canonical SMILES

O=C(O)C(C1=CC=C(C=C1)N(=O)=O)CC=2C=CC=C(Cl)C2

Other Names for this Substance

  • Benzenepropanoic acid, 3-chloro-α-(4-nitrophenyl)-
  • 3-Chloro-α-(4-nitrophenyl)benzenepropanoic acid