AC1MCDNI
3-[4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]phenyl]-N-methyl-3-oxopropan-1-imine oxide
Also Known As: KS-00002Z6F|[3-(4-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}phenyl)-3-oxopropylidene](methyl)ammoniumolate|3-[4-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]phenyl]-N-methyl-3-oxopropan-1-imine oxide
CAS: 303151-65-7
| Molecular Formula | C20H20ClF3N4O2 |
|---|---|
| Molecular Weight | 440.12268 g/mol |
| LogP | 3.8641 |
| Topological Polar Surface Area | 62.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 440.12268 |
| Monoisotopic Mass | 440.12268 |
| Heavy Atoms | 30 |
| Complexity | 936.05804 |
Chemical Identifiers
| CAS Number | 303151-65-7 |
|---|---|
| SMILES | C[N+](=CCC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl)[O-] |
Product Overview
AC1MCDNI (CAS 303151-65-7), with molecular formula C20H20ClF3N4O2 and molecular weight 440.12268 g/mol. IUPAC: 3-[4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]phenyl]-N-methyl-3-oxopropan-1-imine oxide.
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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