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Substance Name: Heptanoic acid, (2-(dimethylamino)-1-phenyl)ethyl ester
RN: 67227-07-0
InChIKey: KOONYQJEHOIRLU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H27-N-O2

Molecular Weight

  • 277.405
 
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Names and Synonyms

Synonym

  • beta-Heptoyloxy-beta-phenylethyl dimethylamine

Systematic Name

  • Heptanoic acid, (2-(dimethylamino)-1-phenyl)ethyl ester

Registry Numbers

CAS Registry Number

  • 67227-07-0

System Generated Number

  • 0067227070

Structure Descriptors

InChI

1S/C17H27NO2/c1-4-5-6-10-13-17(19)20-16(14-18(2)3)15-11-8-7-9-12-15/h7-9,11-12,16H,4-6,10,13-14H2,1-3H3

InChIKey

KOONYQJEHOIRLU-UHFFFAOYSA-N

Smiles

c1([C@@H](OC(CCCCCC)=O)CN(C)C)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 3329mg/kg (3329mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 47, Pg. 96, 1934.
rabbit LDLo intravenous 42mg/kg (42mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 47, Pg. 96, 1934.