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Substance Name: 1-Pentylamine, 5-bromo-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate
RN: 42055-00-5
InChIKey: DKPHQPOYNSZPEV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H28-Br-N-O.C2-H2-O4

Molecular Weight

  • 432.352
 
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Names and Synonyms

Synonym

  • 5-Bromo-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-1-pentylamine oxalate

Systematic Name

  • 1-Pentylamine, 5-bromo-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate

Registry Numbers

CAS Registry Number

  • 42055-00-5

System Generated Number

  • 0042055005

Molecular Formulas

Molecular Formula

  • C17-H28-Br-N-O.C2-H2-O4

Molecular Formula Fragments

  • C17-H28-Br-N-O
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H28BrNO.C2H2O4/c1-4-19(12-7-5-6-11-18)13-14-20-17-15(2)9-8-10-16(17)3;3-1(4)2(5)6/h8-10H,4-7,11-14H2,1-3H3;(H,3,4)(H,5,6)

InChIKey

DKPHQPOYNSZPEV-UHFFFAOYSA-N

Smiles

CCN(CCCCCBr)CCOc1c(cccc1C)C.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 125mg/kg (125mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Acta Pharmaceutica Suecica. Vol. 10, Pg. 199, 1973.
mouse LD50 intravenous 30mg/kg (30mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Acta Pharmaceutica Suecica. Vol. 10, Pg. 199, 1973.