Butyrophenone, 4-(4-(m-fluorophenyl)-1-piperazinyl)-3',4',5'-trimethoxy-, monohydrochloride

4-[4-(3-fluorophenyl)piperazin-1-ium-1-yl]-1-(3,4,5-trimethoxyphenyl)butan-1-one chloride

CAS: 23771-09-7

Molecular Formula	`C23H30ClFN2O4`
Molecular Weight	452.9 g/mol
Topological Polar Surface Area	52.4 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	9
Exact Mass	452.1878
Heavy Atoms	31
Complexity	515.0

Chemical Identifiers

CAS Number	23771-09-7
SMILES	`COC1=CC(=CC(=C1OC)OC)C(=O)CCC[NH+]2CCN(CC2)C3=CC(=CC=C3)F.[Cl-]`
InChIKey	`KNWPVTLLVAKQAN-UHFFFAOYSA-N`

📖 Product Overview

Butyrophenone, 4-(4-(m-fluorophenyl)-1-piperazinyl)-3',4',5'-trimethoxy-, monohydrochloride (CAS: 23771-09-7) is a chemical compound with molecular formula C23H30ClFN2O4 and molecular weight 452.9 g/mol. Its IUPAC systematic name is 4-[4-(3-fluorophenyl)piperazin-1-ium-1-yl]-1-(3,4,5-trimethoxyphenyl)butan-1-one chloride. Topological Polar Surface Area 52.4 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 9 Exact Mass 452.1878 Heavy Atoms 31 Complexity 515.0 InChI Key: KNWPVTLLVAKQAN-UHFFFAOYSA-N. SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)CCC[NH+]2CCN(CC2)C3=CC(=CC=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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