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Substance Name: 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)-
RN: 1167-20-0
InChIKey: DJBUNNYSMQHCMK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H28-F3-N-O

Molecular Weight

  • 355.441
 
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Names and Synonyms

Synonyms

  • 3-(3-((alpha,alpha,alpha-Trifluoro-m-tolyl)oxy)propyl)3-azaspiro(5.5)undecane
  • BRN 1352040

Systematic Name

  • 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)-

Registry Numbers

CAS Registry Number

  • 1167-20-0

System Generated Number

  • 0001167200

Structure Descriptors

InChI

1S/C20H28F3NO/c21-20(22,23)17-6-4-7-18(16-17)25-15-5-12-24-13-10-19(11-14-24)8-2-1-3-9-19/h4,6-7,16H,1-3,5,8-15H2

InChIKey

DJBUNNYSMQHCMK-UHFFFAOYSA-N

Smiles

C12(CCN(CCCOc3cc(ccc3)C(F)(F)F)CC1)CCCCC2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 150mg/kg (150mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Journal of Medicinal Chemistry. Vol. 8, Pg. 62, 1965.