5-((4'-((2,6-Diamino-3-methyl-5-((4-sulfophenyl)diazenyl)phenyl)diazenyl)-3,3'-dimethyl[biphenyl]-4-yl)diazenyl)-2-hydroxybenzoic acid
5-[[4-[4-[[2,6-diamino-3-methyl-5-[(4-sulfophenyl)diazenyl]phenyl]diazenyl]-3-methylphenyl]-2-methylphenyl]diazenyl]-2-hydroxybenzoic acid
Also Known As: 5-((4'-((2,6-Diamino-3-methyl-5-((4-sulfophenyl)diazenyl)phenyl)diazenyl)-3,3'-dimethyl[biphenyl]-4-yl)diazenyl)-2-hydroxybenzoic acid|5-{[4'-({2,6-Diamino-3-methyl-5-[(4-sulfophenyl)diazenyl]phenyl}diazenyl)-3,3'-dimethyl[1,1'-biphenyl]-4-yl]diazenyl}-2-hydroxybenzoic acid
| Molecular Formula | C34H30N8O6S |
|---|---|
| Molecular Weight | 678.2009 g/mol |
| LogP | 9.34 |
| Topological Polar Surface Area | 238.1 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 678.2009 |
| Heavy Atoms | 49 |
| Complexity | 2303.5 |
Chemical Identifiers
| CAS Number | 746550-70-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1N)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC4=CC(=C(C=C4)O)C(=O)O)C)C)N)N=NC5=CC=C(C=C5)S(=O)(=O)O |
Product Overview
5-((4'-((2,6-Diamino-3-methyl-5-((4-sulfophenyl)diazenyl)phenyl)diazenyl)-3,3'-dimethyl[biphenyl]-4-yl)diazenyl)-2-hydroxybenzoic acid (CAS 746550-70-9), with molecular formula C34H30N8O6S and molecular weight 678.2009 g/mol. IUPAC: 5-[[4-[4-[[2,6-diamino-3-methyl-5-[(4-sulfophenyl)diazenyl]phenyl]diazenyl]-3-methylphenyl]-2-methylphenyl]diazenyl]-2-hydroxybenzoic acid.
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