Benzenepropanoic acid, β-amino-4-bromo-, hydrochloride (1:1), (βS)-

CAS Registry Number®

930769-56-5
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CAS Name

Benzenepropanoic acid, β-amino-4-bromo-, hydrochloride (1:1), (βS)-

Molecular Formula

C9H10BrNO2.ClH

Cite this Page

Benzenepropanoic acid, β-amino-4-bromo-, hydrochloride (1:1), (βS)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=930769-56-5 (retrieved 2024-09-02) (CAS RN: 930769-56-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    191-193 °C (sublm)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H10BrNO2.ClH/c10-7-3-1-6(2-4-7)8(11)5-9(12)13;/h1-4,8H,5,11H2,(H,12,13);1H/t8-;/m0./s1

InChIKey

InChIKey=UDMBAXSJPLSJGM-QRPNPIFTSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenepropanoic acid, β-amino-4-bromo-, hydrochloride (1:1), (βS)-
  • (3S)-3-Amino-3-(4-bromophenyl)propanoic acid hydrochloride
  • (s)-3-Amino-3-(4-bromophenyl)propanoic acid hydrochloride