RefChem:416327
2-[[4-chloro-6-[3-[(1-hydroxy-4-sulfonaphthalen-2-yl)diazenyl]-4-sulfoanilino]-1,3,5-triazin-2-yl]amino]benzene-1,4-disulfonic acid
Also Known As: 1,4-Benzenedisulfonic acid, 2-((4-chloro-6-((3-((1-hydroxy-4-sulfo-2-naphthalenyl)azo)-4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-|1,4-Benzenedisulfonic acid, 2-((4-chloro-6-((3-(2-(1-hydroxy-4-sulfo-2-naphthalenyl)diazenyl)-4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-|2-((4-Chloro-6-((3-((1-hydroxy-4-sulfo-2-naphthalenyl)azo)-4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-1,4-benzenedisulfonic acid|1,4-Benzenedisulfonic acid, 2-[[4-chloro-6-[[3-[(1-hydroxy-4-sulfo-2-naphthalenyl)azo]-4-sulfophenyl]amino]-1,3,5-triazin-2-yl]amino]-|1,4-Benzenedisulfonic acid, 2-[[4-chloro-6-[[3-[2-(1-hydroxy-4-sulfo-2-naphthalenyl)diazenyl]-4-sulfophenyl]amino]-1,3,5-triazin-2-yl]amino]-|2-[(4-Chloro-6-{3-[(1-hydroxy-4-sulfonaphthalen-2-yl)diazenyl]-4-sulfoanilino}-1,3,5-triazin-2-yl)amino]benzene-1,4-disulfonic acid|2-[[4-Chloro-6-[[3-[(1-hydroxy-4-sulfonaphthalen-2-yl)azo]-4-sulfophenyl]amino]-1,3,5-triazin-2-yl]amino]-1,4-benzenedisulfonic acid|2-[[4-chloro-6-[3-[(2Z)-2-(1-oxo-4-sulfonaphthalen-2-ylidene)hydrazinyl]-4-sulfoanilino]-1,3,5-triazin-2-yl]amino]benzene-1,4-disulfonic acid|2-{[4-chloro-6-({3-[2-(1-hydroxy-4-sulfonaphthalen-2-yl)diazen-1-yl]-4-sulfophenyl}amino)-1,3,5-triazin-2-yl]amino}benzene-1,4-disulfonic acid
| Molecular Formula | C25H18ClN7O13S4 |
|---|---|
| Molecular Weight | 786.95337 g/mol |
| LogP | 4.27 |
| Topological Polar Surface Area | 325.16 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Exact Mass | 786.95337 |
| Heavy Atoms | 50 |
| Complexity | 2694.8 |
Chemical Identifiers
| CAS Number | 64640-24-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC(=C2O)N=NC3=C(C=CC(=C3)NC4=NC(=NC(=N4)Cl)NC5=C(C=CC(=C5)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O |
Product Overview
RefChem:416327 (CAS 64640-24-0), with molecular formula C25H18ClN7O13S4 and molecular weight 786.95337 g/mol. IUPAC: 2-[[4-chloro-6-[3-[(1-hydroxy-4-sulfonaphthalen-2-yl)diazenyl]-4-sulfoanilino]-1,3,5-triazin-2-yl]amino]benzene-1,4-disulfonic acid.
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