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Substance Name: 2-Propanol, 1-(tert-butylamino)-3-(o-cyclopropylphenoxy)-, hydrochloride
RN: 27325-20-8
InChIKey: MCILYEPREBVRTJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H25-N-O2.Cl-H

Molecular Weight

  • 299.839
 
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Names and Synonyms

Synonyms

  • 1-(tert-Butylamino)-3-(o-cyclopropylphenoxy)-2-propanol hydrochloride
  • 2-Propanol, 1-(2-cyclopropylphenoxy)-3-((1,1-dimethylethyl)amino)-, hydrochloride

Systematic Name

  • 2-Propanol, 1-(tert-butylamino)-3-(o-cyclopropylphenoxy)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 27325-20-8

System Generated Number

  • 0027325208

Molecular Formulas

Molecular Formula

  • C16-H25-N-O2.Cl-H

Molecular Formula Fragments

  • C16-H25-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H25NO2.ClH/c1-16(2,3)17-10-13(18)11-19-15-7-5-4-6-14(15)12-8-9-12;/h4-7,12-13,17-18H,8-11H2,1-3H3;1H

InChIKey

MCILYEPREBVRTJ-UHFFFAOYSA-N

Smiles

C([C@@H](CNC(C)(C)C)O)Oc1c(cccc1)C1CC1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 99mg/kg (99mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 971, 1970.