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Substance Name: 1-Pentanone, 4-(3-azabicyclo(3.2.2)non-3-yl)-1-(4-fluorophenyl)-, (+-)-
RN: 35806-31-6
InChIKey: GVGRGFQZLYTPPK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H26-F-N-O

Molecular Weight

  • 303.418
 
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Names and Synonyms

Synonyms

  • (+-)-4-(3-Azabicyclo(3.2.2)non-3-yl)-1-(4-fluorophenyl)-1-pentanone
  • 5-20-04-00379 (Beilstein Handbook Reference)
  • BRN 1647638

Systematic Name

  • 1-Pentanone, 4-(3-azabicyclo(3.2.2)non-3-yl)-1-(4-fluorophenyl)-, (+-)-

Registry Numbers

CAS Registry Number

  • 35806-31-6

System Generated Number

  • 0035806316

Structure Descriptors

InChI

1S/C19H26FNO/c1-14(21-12-15-3-4-16(13-21)6-5-15)2-11-19(22)17-7-9-18(20)10-8-17/h7-10,14-16H,2-6,11-13H2,1H3

InChIKey

GVGRGFQZLYTPPK-UHFFFAOYSA-N

Smiles

C(CC[C@@H](C)N1CC2CCC(C1)CC2)(=O)c1ccc(cc1)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 1009, 1971.