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Substance Name: 1-Butanol, 2-(((2-chlorophenyl)methyl)amino)-, hydrochloride, (S)-
RN: 112767-77-8
InChIKey: ORJGAUNQLJLYSA-HNCPQSOCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-Cl-N-O.Cl-H

Molecular Weight

  • 250.167
 
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Names and Synonyms

Synonym

  • (S)-2-(((2-Chlorophenyl)methyl)amino)-1-butanol hydrochloride

Systematic Name

  • 1-Butanol, 2-(((2-chlorophenyl)methyl)amino)-, hydrochloride, (S)-

Registry Numbers

CAS Registry Number

  • 112767-77-8

System Generated Number

  • 0112767778

Molecular Formulas

Molecular Formula

  • C11-H16-Cl-N-O.Cl-H

Molecular Formula Fragments

  • C11-H16-Cl-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C11H16ClNO.ClH/c1-2-10(8-14)13-7-9-5-3-4-6-11(9)12;/h3-6,10,13-14H,2,7-8H2,1H3;1H/t10-;/m1./s1

InChIKey

ORJGAUNQLJLYSA-HNCPQSOCSA-N

Smiles

c1(c(cccc1)Cl)C[NH2+][C@H](CC)CO.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 253mg/kg (253mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 39, Pg. 309, 1987.
rat LD50 intravenous 380mg/kg (380mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 39, Pg. 309, 1987.