α,2-Diamino-4-chloro-γ-oxobenzenebutanoic acid

CAS Registry Number®

75802-84-5
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CAS Name

α,2-Diamino-4-chloro-γ-oxobenzenebutanoic acid

Molecular Formula

C10H11ClN2O3

Molecular Mass

242.66

Cite this Page

α,2-Diamino-4-chloro-γ-oxobenzenebutanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=75802-84-5 (retrieved 2024-04-25) (CAS RN: 75802-84-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    223 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H11ClN2O3/c11-5-1-2-6(7(12)3-5)9(14)4-8(13)10(15)16/h1-3,8H,4,12-13H2,(H,15,16)

InChIKey

InChIKey=HQLHZNDJQSRKDT-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C(N)CC(=O)C1=CC=C(Cl)C=C1N

Other Names for this Substance

  • Benzenebutanoic acid, α,2-diamino-4-chloro-γ-oxo-
  • Benzenebutanoic acid, α,2-diamino-4-chloro-γ-oxo-, (±)-
  • α,2-Diamino-4-chloro-γ-oxobenzenebutanoic acid
  • 2-Amino-4-(2-amino-4-chlorophenyl)-4-oxobutanoic acid

Deleted or Replaced CAS Registry Numbers

175657-78-0

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