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Substance Name: Acetic acid, 2-chloro-2-phenyl-, 2-pyridylmethyl ester, hydrochloride
RN: 42023-66-5
InChIKey: LNXCVIKZIRVTIQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H12-Cl-N-O2.Cl-H

Molecular Weight

  • 298.168
 
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Names and Synonyms

Synonyms

  • Benzeneacetic acid, alpha-chloro-, (2-pyridylmethyl) ester, hydrochloride
  • F 1171
  • Methanol, 2-pyridyl-, alpha-chlorobenzeneacetate hydrochloride

Systematic Name

  • Acetic acid, 2-chloro-2-phenyl-, 2-pyridylmethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 42023-66-5

System Generated Number

  • 0042023665

Molecular Formulas

Molecular Formula

  • C14-H12-Cl-N-O2.Cl-H

Molecular Formula Fragments

  • C14-H12-Cl-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H12ClNO2.ClH/c15-13(11-6-2-1-3-7-11)14(17)18-10-12-8-4-5-9-16-12;/h1-9,13H,10H2;1H

InChIKey

LNXCVIKZIRVTIQ-UHFFFAOYSA-N

Smiles

c1([C@@H](C(OCc2cccc[n+]2)=O)Cl)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1780mg/kg (1780mg/kg)   Chimica Therapeutica. Vol. 8, Pg. 297, 1973.