Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Heptanoic acid, 2-hydroxy-2-(2-propynyl)-, 1-methyl-4-piperidyl ester
RN: 101914-04-9
InChIKey: CVFSIFYGTFVJEQ-UHFFFAOYSA-N

Molecular Formula

  • C16-H27-N-O3

Molecular Weight

  • 281.393
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 1-Methyl-4-piperidyl-n-amyl(1-propynyl)glycolate

Systematic Name

  • Heptanoic acid, 2-hydroxy-2-(2-propynyl)-, 1-methyl-4-piperidyl ester

Registry Numbers

CAS Registry Number

  • 101914-04-9

System Generated Number

  • 0101914049

Structure Descriptors

InChI

1S/C16H27NO3/c1-4-6-7-9-16(19,8-5-2)14(18)20-15(3)10-12-17-13-11-15/h2,17,19H,4,6-13H2,1,3H3

InChIKey

CVFSIFYGTFVJEQ-UHFFFAOYSA-N

Smiles

C1(OC([C@@](CCCCC)(CC#C)O)=O)(CCNCC1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 79mg/kg (79mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#11889,