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Substance Name: Piperazine, 1-(4-(alpha-(p-chlorophenyl)benzyloxy)butyl)-4-(o-tolyl)-, oxalate
RN: 23904-93-0
InChIKey: UGXWMPTVDJFREO-UHFFFAOYSA-N

Molecular Formula

  • C28-H33-Cl-N2-O.C2-H2-O4

Molecular Weight

  • 539.068
 
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Names and Synonyms

Synonym

  • 1-(4-(alpha-(p-Chlorophenyl)benzyloxy)butyl)-4-(o-tolyl)piperazine oxalate

Systematic Name

  • Piperazine, 1-(4-(alpha-(p-chlorophenyl)benzyloxy)butyl)-4-(o-tolyl)-, oxalate

Registry Numbers

CAS Registry Number

  • 23904-93-0

System Generated Number

  • 0023904930

Molecular Formulas

Molecular Formula

  • C28-H33-Cl-N2-O.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C28-H33-Cl-N2-O
  • COMPONENT

Structure Descriptors

InChI

1S/C28H33ClN2O.C2H2O4/c1-23-9-5-6-12-27(23)31-20-18-30(19-21-31)17-7-8-22-32-28(24-10-3-2-4-11-24)25-13-15-26(29)16-14-25;3-1(4)2(5)6/h2-6,9-16,28H,7-8,17-22H2,1H3;(H,3,4)(H,5,6)

InChIKey

UGXWMPTVDJFREO-UHFFFAOYSA-N

Smiles

N1(c2ccccc2C)CCN(CCCCO[C@@H](c2ccc(cc2)Cl)c2ccccc2)CC1.OC(C(O)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 75mg/kg (75mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 860, 1969.