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Substance Name: 2-Octyn-4-ol, 1-(bis(2-chloroethyl)amino)-4,7-dimethyl-, hydrochloride
RN: 40513-56-2
InChIKey: DXKCKWSMRAZRQH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H25-Cl2-N-O.Cl-H

Molecular Weight

  • 330.724
 
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Names and Synonyms

Synonym

  • 4,7-Dimethyl-1-bis-(2-chloroethyl)amino-2-octyn-4-ol hydrochloride

Systematic Name

  • 2-Octyn-4-ol, 1-(bis(2-chloroethyl)amino)-4,7-dimethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 40513-56-2

System Generated Number

  • 0040513562

Molecular Formulas

Molecular Formula

  • C14-H25-Cl2-N-O.Cl-H

Molecular Formula Fragments

  • C14-H25-Cl2-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H25Cl2NO.ClH/c1-13(2)5-7-14(3,18)6-4-10-17(11-8-15)12-9-16;/h13,18H,5-9,11-12H2,1-3H3;1H

InChIKey

DXKCKWSMRAZRQH-UHFFFAOYSA-N

Smiles

[N+](C#CC[C@@](CCC(C)C)(C)O)(CCCl)CCCl.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 75mg/kg (75mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

SKIN AND APPENDAGES (SKIN): HAIR: OTHER

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION
Russian Pharmacology and Toxicology Vol. 43, Pg. 68, 1980.