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Substance Name: 1(2H)-Pentalenone, 3,4,5,6-tetrahydro-2-((dimethylamino)methyl)-3-methyl-, hydrochloride
RN: 88364-06-1
InChIKey: JWBPOZJBFCILTL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H19-N-O.Cl-H

Molecular Weight

  • 229.749
 
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Names and Synonyms

Synonym

  • 2-((Dimethylamino)methyl)-3-methyl-3,4,5,6-tetrahydro-1(2H)-pentalenone hydrochloride

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 88364-06-1

System Generated Number

  • 0088364061

Molecular Formulas

Molecular Formula

  • C12-H19-N-O.Cl-H

Molecular Formula Fragments

  • C12-H19-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H19NO.ClH/c1-8-9-5-4-6-10(9)12(14)11(8)7-13(2)3;/h8,11H,4-7H2,1-3H3;1H

InChIKey

JWBPOZJBFCILTL-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 407mg/kg (407mg/kg)   Farmaco, Edizione Scientifica. Vol. 38, Pg. 702, 1983.