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Substance Name: 4-Chlorophenylalanine methyl ester
RN: 23434-96-0
UNII: ZA5R0QT27X
InChIKey: FBHPVOLRIXZZMD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H12-Cl-N-O2

Molecular Weight

  • 213.663
 
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Names and Synonyms

Name of Substance

  • 4-Chlorophenylalanine methyl ester

Synonyms

  • 4-14-00-01674 (Beilstein Handbook Reference)
  • 4-Chlorophenylalanine methyl ester
  • BRN 3032592
  • CCRIS 8841
  • EINECS 245-661-8
  • H69/17
  • p-Chlorophenylalanine methyl ester
  • UNII-ZA5R0QT27X

Systematic Names

  • Alanine, 3-(p-chlorophenyl)-, methyl ester
  • Methyl 4-chloro-3-phenylalaninate
  • Phenylalanine, 4-chloro-, methyl ester (9CI)

Registry Numbers

CAS Registry Number

  • 23434-96-0

FDA UNII

  • ZA5R0QT27X

Related Registry Number

  • 23434-91-5 (hydrochloride)

System Generated Number

  • 0023434960

Structure Descriptors

InChI

1S/C10H12ClNO2/c1-14-10(13)9(12)6-7-2-4-8(11)5-3-7/h2-5,9H,6,12H2,1H3

InChIKey

FBHPVOLRIXZZMD-UHFFFAOYSA-N

Smiles

c1(C[C@@H](C(OC)=O)N)ccc(Cl)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1640mg/kg (1640mg/kg)   Toxicology and Applied Pharmacology. Vol. 28, Pg. 227, 1974.