Crystal violet
[4-[bis[4-(dimethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium chloride
| Molecular Formula | C25H30ClN3 |
|---|---|
| Molecular Weight | 408.0 g/mol |
| Topological Polar Surface Area | 9.5 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.21283 |
| Heavy Atoms | 29 |
| Complexity | 542.0 |
Chemical Identifiers
| CAS Number | 548-62-9 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.[Cl-] |
| InChIKey | ZXJXZNDDNMQXFV-UHFFFAOYSA-M |
📖 Product Overview
Crystal violet (CAS: 548-62-9) is a chemical compound with molecular formula C25H30ClN3 and molecular weight 408.0 g/mol. Its IUPAC systematic name is [4-[bis[4-(dimethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium chloride.
ZXJXZNDDNMQXFV-UHFFFAOYSA-M.
SMILES: CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.[Cl-].
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