DIPHEMANIL METHYLSULFATE
4-benzhydrylidene-1,1-dimethylpiperidin-1-ium;methyl sulfate
| Molecular Formula | C21H27NO4S |
|---|---|
| Molecular Weight | 389.5 g/mol |
| Topological Polar Surface Area | 74.8 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 389.16608 |
| Heavy Atoms | 27 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 62-97-5 |
|---|---|
| SMILES | C[N+]1(CCC(=C(C2=CC=CC=C2)C3=CC=CC=C3)CC1)C.COS(=O)(=O)[O-] |
| InChIKey | BREMLQBSKCSNNH-UHFFFAOYSA-M |
📖 Product Overview
DIPHEMANIL METHYLSULFATE (CAS: 62-97-5) is a chemical compound with molecular formula C21H27NO4S and molecular weight 389.5 g/mol. Its IUPAC systematic name is 4-benzhydrylidene-1,1-dimethylpiperidin-1-ium;methyl sulfate.
BREMLQBSKCSNNH-UHFFFAOYSA-M.
SMILES: C[N+]1(CCC(=C(C2=CC=CC=C2)C3=CC=CC=C3)CC1)C.COS(=O)(=O)[O-].
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