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Substance Name: Butyrophenone, 4'-fluoro-4-(3a,4,7,7a-tetrahydroisoindol-2-yl)-, hydrochloride
RN: 15997-70-3
InChIKey: BFOVZDGLPSVRSW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H17-F-N4-O2-S2

Molecular Weight

  • 287.3758
 
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Names and Synonyms

Synonym

  • p-Fluoro-4-(3a,4,7,7a-tetrahydroisoindolinyl)butyrophenone hydrochloride

Systematic Name

  • Butyrophenone, 4'-fluoro-4-(3a,4,7,7a-tetrahydroisoindol-2-yl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 15997-70-3

System Generated Number

  • 0015997703

Structure Descriptors

InChI

1S/C18H22FNO/c19-17-9-7-14(8-10-17)18(21)6-3-11-20-12-15-4-1-2-5-16(15)13-20/h1-2,7-10,15-16H,3-6,11-13H2

InChIKey

BFOVZDGLPSVRSW-UHFFFAOYSA-N

Smiles

c1cc(ccc1C(=O)CCCN2CC3CC=CCC3C2)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 50mg/kg (50mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Journal of Medicinal Chemistry. Vol. 10, Pg. 621, 1967.