AC1L91MZ
2-[[2-(3,5-dinitrophenyl)-2-hydroxy-5,5-dimethyl-4-phenyl-1,3-dioxolan-4-yl]oxy]ethyl-trimethylazanium
Also Known As: 2-{[2-(3,5-Dinitrophenyl)-2-hydroxy-5,5-dimethyl-4-phenyl-1,3-dioxolan-4-yl]oxy}-N,N,N-trimethylethan-1-aminium|2-[[2-(3,5-dinitrophenyl)-2-hydroxy-5,5-dimethyl-4-phenyl-1,3-dioxolan-4-yl]oxy]ethyl-trimethylazanium
CAS: 7474-27-3
| Molecular Formula | C22H28N3O8+ |
|---|---|
| Molecular Weight | 462.18765 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 462.18765 |
| Monoisotopic Mass | 462.18765 |
| Heavy Atoms | 33 |
| Complexity | 703.0 |
Chemical Identifiers
| CAS Number | 7474-27-3 |
|---|---|
| SMILES | CC1(C(OC(O1)(C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])O)(C3=CC=CC=C3)OCC[N+](C)(C)C)C |
| InChIKey | KMWOVBCZVBAMIX-UHFFFAOYSA-N |
Product Overview
AC1L91MZ (CAS 7474-27-3), with molecular formula C22H28N3O8+ and molecular weight 462.18765 g/mol. IUPAC: 2-[[2-(3,5-dinitrophenyl)-2-hydroxy-5,5-dimethyl-4-phenyl-1,3-dioxolan-4-yl]oxy]ethyl-trimethylazanium.
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.
View MSDS →
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