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Substance Name: Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride
RN: 67292-70-0
InChIKey: BPKQTTDKJOKFGI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-N-O3.Cl-H

Molecular Weight

  • 359.8508
 
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Names and Synonyms

Synonym

  • 8-(Diethylaminomethyl)-7-hydroxyisoflavone hydrochloride

Systematic Name

  • Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride

Registry Numbers

CAS Registry Number

  • 67292-70-0

System Generated Number

  • 0067292700

Molecular Formulas

Molecular Formula

  • C20-H21-N-O3.Cl-H

Molecular Formula Fragments

  • C20-H21-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H21NO3.ClH/c1-3-21(4-2)12-16-18(22)11-10-15-19(23)17(13-24-20(15)16)14-8-6-5-7-9-14;/h5-11,13,22H,3-4,12H2,1-2H3;1H

InChIKey

BPKQTTDKJOKFGI-UHFFFAOYSA-N

Smiles

CC[NH+](CC)Cc1c(ccc2c1occ(c2=O)c3ccccc3)O.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Journal of Medicinal and Pharmaceutical Chemistry. Vol. 3, Pg. 471, 1961.