C.I. Pigment Blue 61
| Chemical identification | |
|---|---|
| CAS identifier | 1324-76-1 |
| Pubchem identifier | 156614038 |
| DSSTox identifier | DTXSID2027383 |
| IUPAC name | 4-[(4-anilinophenyl)-(4-phenyliminocyclohexa-2,5-dien-1-ylidene)methyl]-N-phenylaniline sulfuric acid |
| Structure | 2D:2D MOL2D MOL22D SDF 3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT |
| SMILES | c1ccc(cc1)/N=C/1C=CC(=C(c2ccc(cc2)Nc2ccccc2)c2ccc(cc2)Nc2ccccc2)C=C1.OS(=O)(=O)O |
| InChI | InChI=1S/C37H29N3.H2O4S/c1-4-10-31(11-5-1)38-34-22-16-28(17-23-34)37(29-18-24-35(25-19-29)39-32-12-6-2-7-13-32)30-20-26-36(27-21-30)40-33-14-8-3-9-15-33;1-5(2,3)4/h1-27,38-39H;(H2,1,2,3,4) |
| InChIKey | HSNDLXNGWWYKRS-UHFFFAOYSA-N |
| Chemical classification | |
|---|---|
| Kingdom | Organic compounds |
| Superclass | - |
| Class | - |
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