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Substance Name: 1(2H)-Pentalenone, 3,4,5,6-tetrahydro-3-methyl-2-(1-piperazinylmethyl)-, hydrochloride
RN: 88364-14-1
InChIKey: UXCPPHBFYSNJOW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H22-N2-O.Cl-H

Molecular Weight

  • 270.8017
 
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Names and Synonyms

Synonym

  • 3-Methyl-2-(1-piperazinylmethyl)-3,4,5,6-tetrahydro-1(2H)-pentalenone hydrochloride

Systematic Name

  • 1(2H)-Pentalenone, 3,4,5,6-tetrahydro-3-methyl-2-(1-piperazinylmethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 88364-14-1

System Generated Number

  • 0088364141

Molecular Formulas

Molecular Formula

  • C14-H22-N2-O.Cl-H

Molecular Formula Fragments

  • C14-H22-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H22N2O.ClH/c1-10-11-3-2-4-12(11)14(17)13(10)9-16-7-5-15-6-8-16;/h10,13,15H,2-9H2,1H3;1H

InChIKey

UXCPPHBFYSNJOW-UHFFFAOYSA-N

Smiles

CC1C(C(=O)C2=C1CCC2)CN3CCNCC3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 426mg/kg (426mg/kg)   Farmaco, Edizione Scientifica. Vol. 38, Pg. 702, 1983.