Butyrophenone, 4'-fluoro-4-(9-methyl-3,9-diazaspiro(5.5)undec-3-yl)-, dihydrochloride

1-(4-fluorophenyl)-4-(9-methyl-3,9-diazoniaspiro[5.5]undecan-3-yl)butan-1-one dichloride

CAS: 1164-74-5

Molecular Formula	`C20H31Cl2FN2O`
Molecular Weight	405.4 g/mol
Topological Polar Surface Area	26.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	404.17975
Heavy Atoms	26
Complexity	402.0

Chemical Identifiers

CAS Number	1164-74-5
SMILES	`C[NH+]1CCC2(CC1)CC[NH+](CC2)CCCC(=O)C3=CC=C(C=C3)F.[Cl-].[Cl-]`
InChIKey	`MHPSVUBTALLMNU-UHFFFAOYSA-N`

📖 Product Overview

Butyrophenone, 4'-fluoro-4-(9-methyl-3,9-diazaspiro(5.5)undec-3-yl)-, dihydrochloride (CAS: 1164-74-5) is a chemical compound with molecular formula C20H31Cl2FN2O and molecular weight 405.4 g/mol. Its IUPAC systematic name is 1-(4-fluorophenyl)-4-(9-methyl-3,9-diazoniaspiro[5.5]undecan-3-yl)butan-1-one dichloride. Topological Polar Surface Area 26.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 404.17975 Heavy Atoms 26 Complexity 402.0 InChI Key: MHPSVUBTALLMNU-UHFFFAOYSA-N. SMILES: C[NH+]1CCC2(CC1)CC[NH+](CC2)CCCC(=O)C3=CC=C(C=C3)F.[Cl-].[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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