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Substance Name: Benzyl alcohol, alpha-(1-(1-imidazolyl)ethyl)-4-phenethyl-, hydrochloride
RN: 77234-91-4
InChIKey: UFDHMHUTGWPJHQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H22-N2-O.Cl-H

Molecular Weight

  • 342.868
 
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Names and Synonyms

Synonym

  • 1-Propanol, 1-(p-phenethylphenyl)-2-(1-imidazolyl)-, hydrochloride

Systematic Name

  • Benzyl alcohol, alpha-(1-(1-imidazolyl)ethyl)-4-phenethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 77234-91-4

System Generated Number

  • 0077234914

Molecular Formulas

Molecular Formula

  • C20-H22-N2-O.Cl-H

Molecular Formula Fragments

  • C20-H22-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H22N2O.ClH/c1-16(22-12-11-21-15-22)20-13-18(9-10-19(20)14-23)8-7-17-5-3-2-4-6-17;/h2-6,9-13,15-16,23H,7-8,14H2,1H3;1H

InChIKey

UFDHMHUTGWPJHQ-UHFFFAOYSA-N

Smiles

c1(c(ccc(c1)CCc1ccccc1)CO)[C@@H]([N+]1C=CN=C1)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 180mg/kg (180mg/kg) BEHAVIORAL: ANTICONVULSANT Journal of Medicinal Chemistry. Vol. 24, Pg. 727, 1981.