Butyrophenone, 4'-fluoro-4-(3a,4,7,7a-tetrahydro-4,7-ethanoisoindolin-2-yl)-, hydrochloride

4-(4-azoniatricyclo[5.2.2.02,6]undeca-3,8-dien-4-yl)-1-(4-fluorophenyl)butan-1-one chloride

CAS: 14200-12-5

Molecular Formula	`C20H23ClFNO`
Molecular Weight	347.9 g/mol
Topological Polar Surface Area	20.1 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	347.14523
Heavy Atoms	24
Complexity	518.0

Chemical Identifiers

CAS Number	14200-12-5
SMILES	`C1CC2C=CC1C3C2C=[N+](C3)CCCC(=O)C4=CC=C(C=C4)F.[Cl-]`
InChIKey	`PCMUPTBKPLQIGK-UHFFFAOYSA-M`

📖 Product Overview

Butyrophenone, 4'-fluoro-4-(3a,4,7,7a-tetrahydro-4,7-ethanoisoindolin-2-yl)-, hydrochloride (CAS: 14200-12-5) is a chemical compound with molecular formula C20H23ClFNO and molecular weight 347.9 g/mol. Its IUPAC systematic name is 4-(4-azoniatricyclo[5.2.2.02,6]undeca-3,8-dien-4-yl)-1-(4-fluorophenyl)butan-1-one chloride. Topological Polar Surface Area 20.1 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 5 Exact Mass 347.14523 Heavy Atoms 24 Complexity 518.0 InChI Key: PCMUPTBKPLQIGK-UHFFFAOYSA-M. SMILES: C1CC2C=CC1C3C2C=[N+](C3)CCCC(=O)C4=CC=C(C=C4)F.[Cl-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for Butyrophenone, 4'-fluoro-4-(3a,4,7,7a-tetrahydro-4,7-ethanoisoindolin-2-yl)-, hydrochloride.

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