Phenylalanine, 4-chloro-, ethyl ester, hydrochloride (1:1)

CAS Registry Number®

52031-05-7

CAS Name

Phenylalanine, 4-chloro-, ethyl ester, hydrochloride (1:1)

Molecular Formula

C11H14ClNO2.ClH

Cite this Page

Phenylalanine, 4-chloro-, ethyl ester, hydrochloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=52031-05-7 (retrieved 2024-11-24) (CAS RN: 52031-05-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    158 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H14ClNO2.ClH/c1-2-15-11(14)10(13)7-8-3-5-9(12)6-4-8;/h3-6,10H,2,7,13H2,1H3;1H

InChIKey

InChIKey=FDQIKGOQYNZYOO-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

Cl.O=C(OCC)C(N)CC1=CC=C(Cl)C=C1

Other Names for this Substance

  • Phenylalanine, 4-chloro-, ethyl ester, hydrochloride (1:1)
  • DL-Phenylalanine, 4-chloro-, ethyl ester, hydrochloride
  • Phenylalanine, 4-chloro-, ethyl ester, hydrochloride
  • DL-p-Chlorophenylalanine ethyl ester hydrochloride
  • p-Chlorophenylalanine ethyl ester hydrochloride

Deleted or Replaced CAS Registry Numbers

40915-49-9