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Substance Name: 2-Pyrrolidinone, 1-(4-((2-bromoethyl)methylamino)-2-butynyl)-, dihydrobromide
RN: 106976-62-9
InChIKey: SPGAMTMQSVTNGA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H17-Br-N2-O.2Br-H

Molecular Weight

  • 434.9961
 
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Names and Synonyms

Synonyms

  • 1-(4-((2-Bromoethyl)methylamino)-2-butynyl)-2-pyrrolidinone dihydrobromide
  • BR 401 dihydrobromide

Systematic Name

  • 2-Pyrrolidinone, 1-(4-((2-bromoethyl)methylamino)-2-butynyl)-, dihydrobromide

Registry Numbers

CAS Registry Number

  • 106976-62-9

Related Registry Number

  • 106976-61-8 (Parent)

System Generated Number

  • 0106976629

Molecular Formulas

Molecular Formula

  • C11-H17-Br-N2-O.2Br-H

Molecular Formula Fragments

  • Br-H
  • C11-H17-Br-N2-O
  • COMPONENT

Structure Descriptors

InChI

1S/C11H17BrN2O.2BrH/c1-13(10-6-12)7-2-3-8-14-9-4-5-11(14)15;;/h4-10H2,1H3;2*1H

InChIKey

SPGAMTMQSVTNGA-UHFFFAOYSA-N

Smiles

CN(CCBr)CC#CCN1CCCC1=O.Br.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 27295ug/kg (27.295mg/kg) BEHAVIORAL: ANALGESIA

BEHAVIORAL: TREMOR

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS
Journal of Pharmacology and Experimental Therapeutics. Vol. 240, Pg. 370, 1987.
mouse LD50 intravenous 513ug/kg (0.513mg/kg) BEHAVIORAL: ANALGESIA

BEHAVIORAL: TREMOR

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS
Journal of Pharmacology and Experimental Therapeutics. Vol. 240, Pg. 370, 1987.