Benzenebutanoic acid, β-amino-3-cyano-, hydrochloride (1:1), (βR)-

CAS Registry Number®

332061-87-7

CAS Name

Benzenebutanoic acid, β-amino-3-cyano-, hydrochloride (1:1), (βR)-

Molecular Formula

C11H12N2O2.ClH

Cite this Page

Benzenebutanoic acid, β-amino-3-cyano-, hydrochloride (1:1), (βR)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=332061-87-7 (retrieved 2024-12-04) (CAS RN: 332061-87-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H12N2O2.ClH/c12-7-9-3-1-2-8(4-9)5-10(13)6-11(14)15;/h1-4,10H,5-6,13H2,(H,14,15);1H/t10-;/m1./s1

InChIKey

InChIKey=NJAIOCXWQMXNIX-HNCPQSOCSA-N

SMILES

C([C@H](CC(O)=O)N)C1=CC(C#N)=CC=C1.Cl

Canonical SMILES

Cl.N#CC1=CC=CC(=C1)CC(N)CC(=O)O

Other Names for this Substance

  • Benzenebutanoic acid, β-amino-3-cyano-, hydrochloride (1:1), (βR)-
  • Benzenebutanoic acid, β-amino-3-cyano-, monohydrochloride, (βR)-

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