β-Amino-3,5-dichlorobenzenepropanoic acid

CAS Registry Number®

188812-95-5
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CAS Name

β-Amino-3,5-dichlorobenzenepropanoic acid

Molecular Formula

C9H9Cl2NO2

Molecular Mass

234.08

Cite this Page

β-Amino-3,5-dichlorobenzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=188812-95-5 (retrieved 2024-07-06) (CAS RN: 188812-95-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    225-228 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9Cl2NO2/c10-6-1-5(2-7(11)3-6)8(12)4-9(13)14/h1-3,8H,4,12H2,(H,13,14)

InChIKey

InChIKey=MQEZPQHIAIRXQC-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)CC(N)C=1C=C(Cl)C=C(Cl)C1

Other Names for this Substance

  • Benzenepropanoic acid, β-amino-3,5-dichloro-
  • β-Amino-3,5-dichlorobenzenepropanoic acid
  • 3-Amino-3-(3,5-dichlorophenyl)propionic acid
  • 3-Amino-3-(3,5-dichlorophenyl)propanoic acid