ACMC-20mbhl
4-[4-[2-hydroxy-3-(4-phenylpyridin-1-ium-1-yl)propoxy]benzoyl]benzonitrile chloride
Also Known As: ACMC-20mbhl|1-(3-(p-(p-Cyanobenzoyl)phenoxy)-2-hydroxypropyl)-4-phenylpyridinium chloride|1-(3-(4-(4-Cyanobenzoyl)phenoxy)-2-hydroxypropyl)-4-phenylpyridinium chloride|Pyridinium, 1-(3-(4-(4-cyanobenzoyl)phenoxy)-2-hydroxypropyl)-4-phenyl-, chloride|Pyridinium,1-[3-[4-(4-cyanobenzoyl)phenoxy]-2-hydroxypropyl]-4-phenyl-, chloride (1:1)|1-{3-[4-(4-Cyanobenzoyl)phenoxy]-2-hydroxypropyl}-4-phenylpyridin-1-ium chloride|4-[4-[2-hydroxy-3-(4-phenylpyridin-1-ium-1-yl)propoxy]benzoyl]benzonitrile chloride
| Molecular Formula | C28H23ClN2O3 |
|---|---|
| Molecular Weight | 470.1397 g/mol |
| LogP | 1.18768 |
| Topological Polar Surface Area | 74.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 470.1397 |
| Monoisotopic Mass | 470.1397 |
| Heavy Atoms | 34 |
| Complexity | 1250.5531 |
Chemical Identifiers
| CAS Number | 108357-22-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(COC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)C#N)O.[Cl-] |
Product Overview
ACMC-20mbhl (CAS 108357-22-8), with molecular formula C28H23ClN2O3 and molecular weight 470.1397 g/mol. IUPAC: 4-[4-[2-hydroxy-3-(4-phenylpyridin-1-ium-1-yl)propoxy]benzoyl]benzonitrile chloride.