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Substance Name: 2H-Tetrazole-2-ethanamine, N,N-diethyl-5-(4-methoxyphenyl)-, hydrochloride, hydrate (1:1:1)
RN: 158553-48-1
InChIKey: FPBWQHONJQVOOA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H21-N5-O.Cl-H.H2-O

Molecular Weight

  • 311.8148
 
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Names and Synonyms

Synonym

  • N,N-Diethyl-5-(4-methoxyphenyl)-2H-tetrazole-2-ethanamine hydrochloride hydrate (1:1:1)

Systematic Name

  • 2H-Tetrazole-2-ethanamine, N,N-diethyl-5-(4-methoxyphenyl)-, hydrochloride, hydrate (1:1:1)

Registry Numbers

CAS Registry Number

  • 158553-48-1

System Generated Number

  • 0158553481

Molecular Formulas

Molecular Formula

  • C14-H21-N5-O.Cl-H.H2-O

Molecular Formula Fragments

  • C14-H21-N5-O
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C14H21N5O.ClH/c1-4-18(5-2)10-11-19-16-14(15-17-19)12-6-8-13(20-3)9-7-12;/h6-9H,4-5,10-11H2,1-3H3;1H

InChIKey

FPBWQHONJQVOOA-UHFFFAOYSA-N

Smiles

CCN(CC)CCn1nc(nn1)c2ccc(cc2)OC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg)   Pharmaceutical Chemistry Journal Vol. 27, Pg. 204, 1993.