Acetophenone, 2-(4-(p-tert-butylbenzyl)piperazinyl)-3',4',5'-trimethoxy-, dihydrochloride
2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-1-[3,4,5-tris(hydroxymethyl)phenyl]ethanone;dihydrochloride
| Molecular Formula | C26H38Cl2N2O4 |
|---|---|
| Molecular Weight | 513.5 g/mol |
| Topological Polar Surface Area | 84.2 A2 |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 512.2209 |
| Heavy Atoms | 34 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 16785-31-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)CC(=O)C3=CC(=C(C(=C3)CO)CO)CO.Cl.Cl |
| InChIKey | SLQYSWPYVBTZPE-UHFFFAOYSA-N |
📖 Product Overview
Acetophenone, 2-(4-(p-tert-butylbenzyl)piperazinyl)-3',4',5'-trimethoxy-, dihydrochloride (CAS: 16785-31-2) is a chemical compound with molecular formula C26H38Cl2N2O4 and molecular weight 513.5 g/mol. Its IUPAC systematic name is 2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-1-[3,4,5-tris(hydroxymethyl)phenyl]ethanone;dihydrochloride.
SLQYSWPYVBTZPE-UHFFFAOYSA-N.
SMILES: CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)CC(=O)C3=CC(=C(C(=C3)CO)CO)CO.Cl.Cl.
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