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Substance Name: Benzoic acid, 4-((2-chloro-1-(hydroxymethyl)ethyl)amino)-, ethyl ester
RN: 182227-96-9
InChIKey: GKJLCTORZIGKPV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H16-Cl-N-O3

Molecular Weight

  • 257.7154
 
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Names and Synonyms

Synonyms

  • 4-(1-Chloro-3-hydroxy-2-propylamino)benzoic acid ethyl ester
  • Ethyl 4-((2-chloro-1-(hydroxymethyl)ethyl)amino)benzoate

Systematic Name

  • Benzoic acid, 4-((2-chloro-1-(hydroxymethyl)ethyl)amino)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 182227-96-9

System Generated Number

  • 0182227969

Structure Descriptors

InChI

1S/C12H16ClNO3/c1-2-17-12(16)9-3-5-10(6-4-9)14-11(7-13)8-15/h3-6,11,14-15H,2,7-8H2,1H3

InChIKey

GKJLCTORZIGKPV-UHFFFAOYSA-N

Smiles

CCOC(=O)c1ccc(cc1)NC(CO)CCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1500mg/kg (1500mg/kg)   Pharmaceutical Chemistry Journal Vol. 30, Pg. 465, 1996.