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Substance Name: 2-Piperidineethanol, 1-butyl-, benzoate
RN: 78219-30-4
InChIKey: PNCGYJRBAPVTFP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H27-N-O2

Molecular Weight

  • 289.4163
 
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Names and Synonyms

Synonyms

  • 4-21-00-00088 (Beilstein Handbook Reference)
  • Benzoic acid, 2-(1-butyl-2-piperidyl)ethyl ester
  • beta-(1-Butyl-2-piperidyl)ethyl benzoate
  • BRN 0208588

Systematic Name

  • 2-Piperidineethanol, 1-butyl-, benzoate

Registry Numbers

CAS Registry Number

  • 78219-30-4

System Generated Number

  • 0078219304

Structure Descriptors

InChI

1S/C18H27NO2/c1-2-3-13-19-14-8-7-11-17(19)12-15-21-18(20)16-9-5-4-6-10-16/h4-6,9-10,17H,2-3,7-8,11-15H2,1H3

InChIKey

PNCGYJRBAPVTFP-UHFFFAOYSA-N

Smiles

CCCCN1CCCCC1CCOC(=O)c2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 15mg/kg (15mg/kg)   Journal of the American Chemical Society. Vol. 61, Pg. 961, 1939.