AC1L48PU structure

AC1L48PU

[9-[2,7-bis(trimethylazaniumyl)anthracen-9-yl]-7-(trimethylazaniumyl)anthracen-2-yl]-trimethylazanium tetrachloride

Also Known As: 2,2',7,7'-tetrakis(trimethylammonio)-9,9'-dianthracene tetrachloride|N,N,N,N',N',N',N'',N'',N'',N''',N''',N'''-Dodecamethyl-(9,9'-bianthracene)-2,2',7,7'-tetraminium tetrachloride|(9,9'-Bianthracene)-2,2',7,7'-tetraminium, N,N,N,N',N',N',N'',N'',N'',N''',N''',N'''-dodecamethyl-, tetrachloride|[9,9'-Bianthracene]-2,2',7,7'-tetraminium, N,N,N,N',N',N',N'',N'',N'',N''',N''',N'''-dodecamethyl-, tetrachloride|[9-[2,7-bis(trimethylazaniumyl)anthracen-9-yl]-7-(trimethylazaniumyl)anthracen-2-yl]-trimethylazanium tetrachloride|N~2~,N~2~,N~2~,N~2'~,N~2'~,N~2'~,N~7~,N~7~,N~7~,N~7'~,N~7'~,N~7'~-Dodecamethyl[9,9'-bianthracene]-2,2',7,7'-tetrakis(aminium) tetrachloride

CAS: 65201-99-2
Molecular Formula C40H50Cl4N4
Molecular Weight 726.27893 g/mol
LogP -3.2308
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 5
Exact Mass 726.27893
Monoisotopic Mass 726.27893
Heavy Atoms 48
Complexity 837.0

Chemical Identifiers

CAS Number 65201-99-2
SMILES C[N+](C)(C)C1=CC2=C(C3=C(C=CC(=C3)[N+](C)(C)C)C=C2C=C1)C4=C5C=C(C=CC5=CC6=C4C=C(C=C6)[N+](C)(C)C)[N+](C)(C)C.[Cl-].[Cl-].[Cl-].[Cl-]
InChIKey XUFDDHADFSKJDT-UHFFFAOYSA-J

Product Overview

AC1L48PU (CAS 65201-99-2), with molecular formula C40H50Cl4N4 and molecular weight 726.27893 g/mol. IUPAC: [9-[2,7-bis(trimethylazaniumyl)anthracen-9-yl]-7-(trimethylazaniumyl)anthracen-2-yl]-trimethylazanium tetrachloride.

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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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