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Substance Name: Benzeneethanamine, N,alpha-dimethyl-4-(2-(dimethylamino)ethoxy)-, ethanedioate (1:2)
RN: 126002-18-4
InChIKey: PLWWFUGIHYPJCK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H24-N2-O.2C2-H2-O4

Molecular Weight

  • 416.4242
 
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Names and Synonyms

Synonym

  • N,alpha-Dimethyl-4-(2-(dimethylamino)ethoxy)benzeneethanamine ethanedioate (1:2)

Systematic Name

  • Benzeneethanamine, N,alpha-dimethyl-4-(2-(dimethylamino)ethoxy)-, ethanedioate (1:2)

Registry Numbers

CAS Registry Number

  • 126002-18-4

System Generated Number

  • 0126002184

Molecular Formulas

Molecular Formula

  • C14-H24-N2-O.2C2-H2-O4

Molecular Formula Fragments

  • C14-H24-N2-O
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C14H24N2O.2C2H2O4/c1-12(15-2)11-13-5-7-14(8-6-13)17-10-9-16(3)4;2*3-1(4)2(5)6/h5-8,12,15H,9-11H2,1-4H3;2*(H,3,4)(H,5,6)

InChIKey

PLWWFUGIHYPJCK-UHFFFAOYSA-N

Smiles

CC(Cc1ccc(cc1)OCCN(C)C)NC.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 680mg/kg (680mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 54, Pg. 1721, 1989.