Benzenebutanoic acid, β-amino-, hydrochloride (1:1), (βS)-

CAS Registry Number®

138165-77-2

CAS Name

Benzenebutanoic acid, β-amino-, hydrochloride (1:1), (βS)-

Molecular Formula

C10H13NO2.ClH

Cite this Page

Benzenebutanoic acid, β-amino-, hydrochloride (1:1), (βS)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=138165-77-2 (retrieved 2024-11-21) (CAS RN: 138165-77-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    176-178 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H13NO2.ClH/c11-9(7-10(12)13)6-8-4-2-1-3-5-8;/h1-5,9H,6-7,11H2,(H,12,13);1H/t9-;/m0./s1

InChIKey

InChIKey=MQTMGKGSJOPWJW-FVGYRXGTSA-N

SMILES

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

Canonical SMILES

Cl.O=C(O)CC(N)CC=1C=CC=CC1

Other Names for this Substance

  • Benzenebutanoic acid, β-amino-, hydrochloride (1:1), (βS)-
  • Benzenebutanoic acid, β-amino-, hydrochloride, (S)-
  • Benzenebutanoic acid, β-amino-, hydrochloride, (βS)-
  • (S)-3-Amino-4-phenylbutyric acid hydrochloride
  • (S)-β-Aminobenzenebutanoic acid hydrochloride

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CAS INSIGHTSTM
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