4'-Fluoro-4-(9-methyl-3-azaspiro(5.5)undec-3-yl)butyrophenone

1-(4-fluorophenyl)-4-(9-methyl-3-azoniaspiro[5.5]undecan-3-yl)butan-1-one chloride

CAS: 64-59-5

Molecular Formula	`C21H31ClFNO`
Molecular Weight	367.9 g/mol
Topological Polar Surface Area	21.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	367.20782
Heavy Atoms	25
Complexity	398.0

Chemical Identifiers

CAS Number	64-59-5
SMILES	`CC1CCC2(CC1)CC[NH+](CC2)CCCC(=O)C3=CC=C(C=C3)F.[Cl-]`
InChIKey	`ADPMIFYDMCNJNN-UHFFFAOYSA-N`

📖 Product Overview

4'-Fluoro-4-(9-methyl-3-azaspiro(5.5)undec-3-yl)butyrophenone (CAS: 64-59-5) is a chemical compound with molecular formula C21H31ClFNO and molecular weight 367.9 g/mol. Its IUPAC systematic name is 1-(4-fluorophenyl)-4-(9-methyl-3-azoniaspiro[5.5]undecan-3-yl)butan-1-one chloride. Topological Polar Surface Area 21.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 5 Exact Mass 367.20782 Heavy Atoms 25 Complexity 398.0 InChI Key: ADPMIFYDMCNJNN-UHFFFAOYSA-N. SMILES: CC1CCC2(CC1)CC[NH+](CC2)CCCC(=O)C3=CC=C(C=C3)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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📚 Academic Support

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