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Substance Name: 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-
RN: 73972-47-1
InChIKey: ODFUUKDOWIAKCG-UHFFFAOYSA-N

Molecular Formula

  • C20-H37-N-O2

Molecular Weight

  • 335.5283
 
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Names and Synonyms

Synonym

  • 1-(3-Adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-2-propanol

Systematic Names

  • 1H-Azepine-1-ethanol, hexahydro-alpha-(2-(tricyclo(3.3.1.13,7)dec-1-ylmethoxy)ethyl)-
  • 2-Propanol, 1-(3-adamantylmethoxymethyl)-3-(hexahydro-1H-azepinyl)-

Registry Numbers

CAS Registry Number

  • 73972-47-1

System Generated Number

  • 0073972471

Structure Descriptors

InChI

1S/C21H37NO2/c23-20(15-22-6-3-1-2-4-7-22)5-8-24-16-21-12-17-9-18(13-21)11-19(10-17)14-21/h17-20,23H,1-16H2

InChIKey

ODFUUKDOWIAKCG-UHFFFAOYSA-N

Smiles

C1CCCN(CC1)CC(CCOCC23CC4CC(C2)CC(C4)C3)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 211mg/kg (211mg/kg)   Farmaco, Edizione Scientifica. Vol. 25, Pg. 822, 1970.