Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: p-Toluic acid, imidazol-4-ylmethyl ester, monohydrochloride
RN: 18429-76-0
InChIKey: VXXSRNVYKXSRGE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H12-N2-O2.Cl-H

Molecular Weight

  • 252.7
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • Imidazole-4-methanol, p-toluate (ester), hydrochloride

Systematic Name

  • p-Toluic acid, imidazol-4-ylmethyl ester, monohydrochloride

Registry Numbers

CAS Registry Number

  • 18429-76-0

System Generated Number

  • 0018429760

Molecular Formulas

Molecular Formula

  • C12-H12-N2-O2.Cl-H

Molecular Formula Fragments

  • C12-H12-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H12N2O2.ClH/c1-9-2-4-10(5-3-9)12(15)16-7-11-6-13-8-14-11;/h2-6,8H,7H2,1H3,(H,13,14);1H

InChIKey

VXXSRNVYKXSRGE-UHFFFAOYSA-N

Smiles

C(c1ccc(cc1)C)(=O)OCc1nc[nH]c1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Pharmaceutical Chemistry Journal Vol. 2, Pg. 360, 1968.