AC1MDP2M
1-phenyl-2-[(4,4,8-trimethyl-5H-dithiolo[3,4-c]quinolin-2-ium-1-yl)sulfanyl]ethanone bromide
Also Known As: CCG-2521|phenacyl-(4,4,8-trimethyl-5H-dithiolo[3,4-c]quinolin-1-ylidene)sulfanium bromide|4,4,8-trimethyl-1-((2-oxo-2-phenylethyl)thio)-4,5-dihydro-[1,2]dithiolo[3,4-c]quinolin-2-ium bromide|4,4,8-trimethyl-1-[(2-oxo-2-phenylethyl)thio]-4,5-dihydro[1,2]dithiolo[3,4-c]quinolin-2-ium bromide
CAS: 466683-69-2
| Molecular Formula | C21H20BrNOS3 |
|---|---|
| Molecular Weight | 476.98904 g/mol |
| LogP | 3.70572 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 476.98904 |
| Monoisotopic Mass | 476.98904 |
| Heavy Atoms | 27 |
| Complexity | 982.34674 |
Chemical Identifiers
| CAS Number | 466683-69-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(C3=C2C(=[S+]S3)SCC(=O)C4=CC=CC=C4)(C)C.[Br-] |
Product Overview
AC1MDP2M (CAS 466683-69-2), with molecular formula C21H20BrNOS3 and molecular weight 476.98904 g/mol. IUPAC: 1-phenyl-2-[(4,4,8-trimethyl-5H-dithiolo[3,4-c]quinolin-2-ium-1-yl)sulfanyl]ethanone bromide.
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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