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Substance Name: Methyl 5-aminosalicylate
RN: 42753-75-3
InChIKey: MXUHMQZOATZRIK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H9-N-O3

Molecular Weight

  • 167.1631
 
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Names and Synonyms

Name of Substance

  • Methyl 5-aminosalicylate

Synonyms

  • 3-14-00-01457 (Beilstein Handbook Reference)
  • 5-Aminomethylsalicylic acid
  • BRN 2803211
  • Methyl 5-amino-2-hydroxybenzoate
  • Methyl 5-aminosalicylate
  • Methyl m-aminosalicylate

Systematic Names

  • Benzoic acid, 5-amino-2-hydroxy-, methyl ester (9CI)
  • Salicylic acid, 5-amino-, methyl ester

Registry Numbers

CAS Registry Number

  • 42753-75-3

System Generated Number

  • 0042753753

Structure Descriptors

InChI

1S/C8H9NO3/c1-12-8(11)6-4-5(9)2-3-7(6)10/h2-4,10H,9H2,1H3

InChIKey

MXUHMQZOATZRIK-UHFFFAOYSA-N

Smiles

COC(=O)c1cc(ccc1O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous > 500mg/kg (500mg/kg)   Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 61, Pg. 255, 1965.
mouse LD50 oral 7gm/kg (7000mg/kg)   Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 61, Pg. 255, 1965.