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Substance Name: 1-Naphthaleneacetaldehyde, alpha-sec-butyl-alpha-(2-(diisopropylamino)ethyl)-
RN: 30121-11-0
InChIKey: YRNSKZPZXBEROC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H35-N-O

Molecular Weight

  • 353.547
 
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Names and Synonyms

Synonyms

  • alpha-sec-Butyl-alpha-(2-(diisopropylamino)ethyl)-1-naphthaleneacetaldehyde
  • NSC 180693

Systematic Names

  • 1-Naphthaleneacetaldehyde, alpha-(2-(bis(1-methylethyl)amino)ethyl)-alpha-(1-methylpropyl)- (9CI)
  • 1-Naphthaleneacetaldehyde, alpha-sec-butyl-alpha-(2-(diisopropylamino)ethyl)-

Registry Numbers

CAS Registry Number

  • 30121-11-0

System Generated Number

  • 0030121110

Structure Descriptors

InChI

1S/C24H35NO/c1-7-20(6)24(17-26,15-16-25(18(2)3)19(4)5)23-14-10-12-21-11-8-9-13-22(21)23/h8-14,17-20H,7,15-16H2,1-6H3

InChIKey

YRNSKZPZXBEROC-UHFFFAOYSA-N

Smiles

c1([C@@](CCN(C(C)C)C(C)C)(C=O)[C@@H](CC)C)c2c(cccc2)ccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 36mg/kg (36mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 1089, 1970.