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Substance Name: 1,2-Propanediol, 3-(4-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)-1-piperazinyl)-, dihydrochloride
RN: 53073-88-4
InChIKey: VLCPWAXZMCIAJY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H24-N2-O4.2Cl-H

Molecular Weight

  • 381.2974
 
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Names and Synonyms

Synonyms

  • 1-(2-(1,4-Benzodioxanyl)methyl)-4-(2,3-dihydroxypropyl)piperazine dihydrochloride
  • CRL 40034

Systematic Name

  • 1,2-Propanediol, 3-(4-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)-1-piperazinyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 53073-88-4

System Generated Number

  • 0053073884

Molecular Formulas

Molecular Formula

  • C16-H24-N2-O4.2Cl-H

Molecular Formula Fragments

  • C16-H24-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H24N2O4.2ClH/c19-11-13(20)9-17-5-7-18(8-6-17)10-14-12-21-15-3-1-2-4-16(15)22-14;;/h1-4,13-14,19-20H,5-12H2;2*1H

InChIKey

VLCPWAXZMCIAJY-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)OCC(O2)CN3CCN(CC3)CC(CO)O.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 260mg/kg (260mg/kg)   United States Patent Document. Vol. #3959283,