9-(2-Carboxylatophenyl)-3,6-bis((2,6-dimethylphenyl)amino)xanthylium
2-[3-(2,6-dimethylanilino)-6-(2,6-dimethylphenyl)iminoxanthen-9-yl]benzoic acid
Also Known As: EINECS 228-796-7|9-(2-Carboxylatophenyl)-3,6-bis((2,6-dimethylphenyl)amino)xanthylium|2-[3-(2,6-dimethylanilino)-6-(2,6-dimethylphenyl)iminoxanthen-9-yl]benzoic acid|9-(2-Carboxylatophenyl)-3,6-bis[(2,6-dimethylphenyl)amino]xanthylium|Benzoic acid, o-[6-(2,6-xylidino)-3-(2,6-xylylimino)-3H-xanthen-9-yl]-|Xanthylium, 9-(2-carboxyphenyl)-3,6-bis((2,6-dimethylphenyl)amino)-, hydroxide, inner salt|Xanthylium, 9-(2-carboxyphenyl)-3,6-bis[(2,6-dimethylphenyl)amino]-, hydroxide, inner salt
| Molecular Formula | C36H30N2O3 |
|---|---|
| Molecular Weight | 538.22565 g/mol |
| LogP | 9.11 |
| Topological Polar Surface Area | 74.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 538.22565 |
| Heavy Atoms | 41 |
| Complexity | 1961.1 |
Chemical Identifiers
| CAS Number | 6359-25-7 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC2=CC3=C(C=C2)C(=C4C=CC(=NC5=C(C=CC=C5C)C)C=C4O3)C6=CC=CC=C6C(=O)O |
Product Overview
9-(2-Carboxylatophenyl)-3,6-bis((2,6-dimethylphenyl)amino)xanthylium (CAS 6359-25-7), with molecular formula C36H30N2O3 and molecular weight 538.22565 g/mol. IUPAC: 2-[3-(2,6-dimethylanilino)-6-(2,6-dimethylphenyl)iminoxanthen-9-yl]benzoic acid.
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