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Substance Name: 1H-Imidazole-1-ethanamine, N,N-dimethyl-alpha-ethyl-alpha-phenyl-, (Z)-2-butenedioate (2:1)
RN: 98836-48-7
InChIKey: SOERJDXDXUWBLH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H42-N6.C4-H4-O4

Molecular Weight

  • 604.7912
 
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Names and Synonyms

Synonyms

  • 1-((2-Phenyl 2-ethyl) 2-N,N-dimethylaminoethyl)imidazole hemimaleate
  • 1-((2-Phenyl 2-ethyl) 2-N,N-dimethylaminoethyl)imidazole hemimaleate [French]
  • JO 1193
  • N,N-Dimethyl-alpha-ethyl-alpha-phenyl-1H-imidazole-1-ethanamine (Z)-2-butenedioate (2:1)

Systematic Name

  • 1H-Imidazole-1-ethanamine, N,N-dimethyl-alpha-ethyl-alpha-phenyl-, (Z)-2-butenedioate (2:1)

Registry Numbers

CAS Registry Number

  • 98836-48-7

System Generated Number

  • 0098836487

Molecular Formulas

Molecular Formula

  • C30-H42-N6.C4-H4-O4

Molecular Formula Fragments

  • C30-H42-N6
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/2C15H21N3.C4H6O4/c2*1-3-7-14(8-4-1)18(17-12-11-16-13-17)15-9-5-2-6-10-15;5-3(6)1-2-4(7)8/h2*1,3-4,7-8,13,15H,2,5-6,9-12H2;1-2H2,(H,5,6)(H,7,8)

InChIKey

SOERJDXDXUWBLH-UHFFFAOYSA-N

Smiles

c1ccc(cc1)N(C2CCCCC2)N3CCN=C3.c1ccc(cc1)N(C2CCCCC2)N3CCN=C3.C(CC(=O)O)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 326mg/kg (326mg/kg)   European Patent Application. Vol. #0151052,
mouse LD50 oral 559mg/kg (559mg/kg)   European Patent Application. Vol. #0151052,