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Substance Name: Piperazine, 1-((2,4,6-trimethylphenyl)methyl)-, (Z)-2-butenedioate (1:1)
RN: 61014-84-4
InChIKey: HFRZTGINFJAHMZ-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H22-N2.C4-H4-O4

Molecular Weight

  • 334.4134
 
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Names and Synonyms

Synonym

  • 1-((2,4,6-Trimethylphenyl)methyl)piperazine (Z)-2-butenedioate

Systematic Name

  • Piperazine, 1-((2,4,6-trimethylphenyl)methyl)-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 61014-84-4

System Generated Number

  • 0061014844

Molecular Formulas

Molecular Formula

  • C14-H22-N2.C4-H4-O4

Molecular Formula Fragments

  • C14-H22-N2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C14H22N2.C4H4O4/c1-11-8-12(2)14(13(3)9-11)10-16-6-4-15-5-7-16;5-3(6)1-2-4(7)8/h8-9,15H,4-7,10H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

HFRZTGINFJAHMZ-WLHGVMLRSA-N

Smiles

Cc1cc(c(c(c1)C)CN2CCNCC2)C.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 50mg/kg (50mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 41, Pg. 1035, 1976.