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Substance Name: Valeronitrile, 2,2-diisopropyl-5-(dimethylamino)-
RN: 10404-31-6
InChIKey: CIKHVDILYPUSTI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H26-N2

Molecular Weight

  • 210.362
 
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Names and Synonyms

Synonyms

  • 2,2-Diisopropyl-5-(dimethylamino)valeronitrile
  • alpha,alpha-Diisopropyl-alpha-(3-dimethylaminopropyl)acetonitrile
  • BRN 2355688

Systematic Name

  • Valeronitrile, 2,2-diisopropyl-5-(dimethylamino)-

Registry Numbers

CAS Registry Number

  • 10404-31-6

System Generated Number

  • 0010404316

Structure Descriptors

InChI

1S/C13H26N2/c1-11(2)13(10-14,12(3)4)8-7-9-15(5)6/h11-12H,7-9H2,1-6H3

InChIKey

CIKHVDILYPUSTI-UHFFFAOYSA-N

Smiles

C(C(CCCN(C)C)(C(C)C)C(C)C)#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 140mg/kg (140mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 786, 1966.