AC1L9D9P
2-hydroxyethyl-[2-[4-[4-[2-[2-hydroxyethyl(dimethyl)azaniumyl]acetyl]phenyl]phenyl]-2-oxoethyl]-dimethylazanium
Also Known As: (2-hydroxyethyl)[2-(4'-{2-[(2-hydroxyethyl)dimethylazaniumyl]acetyl}-[1,1'-biphenyl]-4-yl)-2-oxoethyl]dimethylazanium|[1,1-Biphenyl]-4,4-diethanaminium,N4,N4-bis(2-hydroxyethyl)-N4,N4,N4,N4-tetramethyl-b4,b4-dioxo-|2-hydroxyethyl-[2-[4-[4-[2-[2-hydroxyethyl(dimethyl)azaniumyl]acetyl]phenyl]phenyl]-2-oxoethyl]-dimethylazanium|N,N -[1,1 -Biphenyl-4,4 -diylbis(2-oxoethane-2,1-diyl)]bis[N,N-dimethyl-2-hydroxyethanaminium]|N,N -[4,4 -Biphenylylenebis(2-oxo-2,1-ethanediyl)]bis[N,N-dimethyl-2-hydroxyethanaminium]|N,N -[Biphenyl-4,4 -diylbis(2-oxoethane-2,1-diyl)]bis(2-hydroxy-N,N-dimethylethanaminium)
| Molecular Formula | C24H34N2O4+2 |
|---|---|
| Molecular Weight | 414.25186 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 414.25186 |
| Monoisotopic Mass | 414.25186 |
| Heavy Atoms | 30 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 63-62-7 |
|---|---|
| SMILES | C[N+](C)(CCO)CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C[N+](C)(C)CCO |
| InChIKey | QBLLHPHWLVNVTJ-UHFFFAOYSA-N |
Product Overview
AC1L9D9P (CAS 63-62-7), with molecular formula C24H34N2O4+2 and molecular weight 414.25186 g/mol. IUPAC: 2-hydroxyethyl-[2-[4-[4-[2-[2-hydroxyethyl(dimethyl)azaniumyl]acetyl]phenyl]phenyl]-2-oxoethyl]-dimethylazanium.