C.I. Direct Blue 22
disodium;1-amino-7-[[4-[4-[(2-hydroxynaphthalen-1-yl)diazenyl]-3-methoxyphenyl]-2-methoxyphenyl]diazenyl]-4-sulfinatonaphthalene-2-sulfonate
| Molecular Formula | C34H25N5Na2O8S2 |
|---|---|
| Molecular Weight | 741.7 g/mol |
| Topological Polar Surface Area | 239.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 741.094 |
| Heavy Atoms | 51 |
| Complexity | 1280.0 |
Chemical Identifiers
| CAS Number | 2586-57-4 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=CC4=CC=CC=C43)O)OC)N=NC5=CC6=C(C=C5)C(=CC(=C6N)S(=O)(=O)[O-])S(=O)[O-].[Na+].[Na+] |
| InChIKey | LRGRYCBPXHHUAU-UHFFFAOYSA-L |
📖 Product Overview
C.I. Direct Blue 22 (CAS: 2586-57-4) is a chemical compound with molecular formula C34H25N5Na2O8S2 and molecular weight 741.7 g/mol. Its IUPAC systematic name is disodium;1-amino-7-[[4-[4-[(2-hydroxynaphthalen-1-yl)diazenyl]-3-methoxyphenyl]-2-methoxyphenyl]diazenyl]-4-sulfinatonaphthalene-2-sulfonate.
LRGRYCBPXHHUAU-UHFFFAOYSA-L.
SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=CC4=CC=CC=C43)O)OC)N=NC5=CC6=C(C=C5)C(=CC(=C6N)S(=O)(=O)[O-])S(=O)[O-].[Na+].[Na+].
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