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Substance Name: Butyronitrile, 4-(dimethylamino)-2-isopropyl-2-(p-propylphenyl)-
RN: 14780-12-2
InChIKey: RCEYYUXZDFAAHA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H28-N2

Molecular Weight

  • 272.433
 
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Names and Synonyms

Synonyms

  • 4-(Dimethylamino)-2-isopropyl-2-(p-propylphenyl)butyronitrile
  • BRN 2127461

Systematic Name

  • Butyronitrile, 4-(dimethylamino)-2-isopropyl-2-(p-propylphenyl)-

Registry Numbers

CAS Registry Number

  • 14780-12-2

System Generated Number

  • 0014780122

Structure Descriptors

InChI

1S/C18H28N2/c1-6-7-16-8-10-17(11-9-16)18(14-19,15(2)3)12-13-20(4)5/h8-11,15H,6-7,12-13H2,1-5H3

InChIKey

RCEYYUXZDFAAHA-UHFFFAOYSA-N

Smiles

c1([C@@](CCN(C)C)(C(C)C)C#N)ccc(CCC)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 80mg/kg (80mg/kg) BEHAVIORAL: IRRITABILITY

BEHAVIORAL: ATAXIA
Chimica Therapeutica. Vol. 2, Pg. 221, 1967.