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Substance Name: 1-Naphthaleneacetaldehyde, alpha-sec-butyl-alpha-(2-(dimethylamino)ethyl)-
RN: 28321-34-8
InChIKey: QXWUSVBGZFCYKJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-N-O

Molecular Weight

  • 297.439
 
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Names and Synonyms

Synonyms

  • 2-(alpha-Naphthyl)-2-(2-dimethylaminoethyl)-3-methylpentanal
  • alpha-sec-Butyl-alpha-(2-(dimethylamino)ethyl)-1-naphthaleneacetaldehyde

Systematic Name

  • 1-Naphthaleneacetaldehyde, alpha-sec-butyl-alpha-(2-(dimethylamino)ethyl)-

Registry Numbers

CAS Registry Number

  • 28321-34-8

System Generated Number

  • 0028321348

Structure Descriptors

InChI

1S/C20H27NO/c1-5-16(2)20(15-22,13-14-21(3)4)19-12-8-10-17-9-6-7-11-18(17)19/h6-12,15-16H,5,13-14H2,1-4H3

InChIKey

QXWUSVBGZFCYKJ-UHFFFAOYSA-N

Smiles

c1(cccc2ccccc12)[C@@](C=O)([C@@H](CC)C)CCN(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 45mg/kg (45mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 1089, 1970.