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Substance Name: Benzyl alcohol, 4-amino-alpha-((tert-butylamino)methyl)-3-fluoro-, hydrochloride
RN: 56795-20-1
InChIKey: ZTOJVVBTYKAIKQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H19-F-N2-O.Cl-H

Molecular Weight

  • 262.754
 
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Names and Synonyms

Synonyms

  • 4-Amino-alpha-((tert-butylamino)methyl)-3-fluorobenzyl alcohol hydrochloride
  • Benzenemethanol, 4-amino-alpha-(((1,1-dimethylethyl)amino)methyl)-3-fluoro-, hydrochloride

Systematic Name

  • Benzyl alcohol, 4-amino-alpha-((tert-butylamino)methyl)-3-fluoro-, hydrochloride

Registry Numbers

CAS Registry Number

  • 56795-20-1

System Generated Number

  • 0056795201

Molecular Formulas

Molecular Formula

  • C12-H19-F-N2-O.Cl-H

Molecular Formula Fragments

  • C12-H19-F-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H19FN2O.ClH/c1-12(2,3)15-7-11(16)8-4-5-10(14)9(13)6-8;/h4-6,11,15-16H,7,14H2,1-3H3;1H

InChIKey

ZTOJVVBTYKAIKQ-UHFFFAOYSA-N

Smiles

C([NH2+]C[C@@H](c1cc(c(N)cc1)F)O)(C)(C)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 69200ug/kg (69.2mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 34, Pg. 1625, 1984.