RefChem:438648
disodium;[5-bromo-2-(9-chloro-3-sulfonatooxybenzo[g][1]benzothiol-2-yl)-1H-indol-3-yl] sulfate
Also Known As: EINECS 233-375-6|C.I.73671|disodium 5-bromo-2-[9-chloro-3-(sulphonatooxy)naphtho[1,2-b]thien-2-yl]-1H-indol-3-yl sulphate|1H-Indol-3-ol, 5-bromo-2-[9-chloro-3-(sulfooxy)naphtho[1,2-b]thien-2-yl]-, hydrogen sulfate (ester), disodium salt|disodium;[5-bromo-2-(9-chloro-3-sulfonatooxybenzo[g][1]benzothiol-2-yl)-1H-indol-3-yl] sulfate|1H-Indol-3-ol, 5-bromo-2-(9-chloro-3-(sulfooxy)naphtho(1,2-b)thien-2-yl)-, 3-(hydrogen sulfate), sodium salt (1:2)|1H-Indol-3-ol, 5-bromo-2-(9-chloro-3-(sulfooxy)naphtho(1,2-b)thien-2-yl)-, hydrogen sulfate (ester), disodium salt|disodium 5-bromo-2-[9-chloro-3-(sulfonatooxy)naphtho[1,2-b]thiophen-2-yl]-1h-indol-3-yl sulfate|Disodium 5-bromo-2-(9-chloro-3-(sulphonatooxy)naphtho(1,2-b)thien-2-yl)-1H-indol-3-yl sulphate|1H-Indol-3-ol, 5-bromo-2-[9-chloro-3-(sulfooxy)naphtho[1,2-b]thien-2-yl]-, 3-(hydrogen sulfate), sodium salt (1:2)|1H-Indol-3-ol,5-bromo-2-(9-chloro-3-(sulfooxy)naphtho(1,2-B)thien-2-yl)-,hydrogen sulfate (ester),disodium salt|disodium [5-bromo-2-(9-chloro-3-sulfonatooxybenzo[g][1]benzothiol-2-yl)-1H-indol-3-yl] sulfate|Indol-3-ol, 5-bromo-2-(9-chloro-3-hydroxynaphtho[1,2-b]thien-2-yl)-, bis(hydrogen sulfate) (ester), disodium salt
| Molecular Formula | C20H9BrClNNa2O8S3 |
|---|---|
| Molecular Weight | 646.81573 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 148.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 646.81573 |
| Heavy Atoms | 36 |
| Complexity | 1855.8 |
Chemical Identifiers
| CAS Number | 10134-35-7 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)Cl)C3=C(C=C2)C(=C(S3)C4=C(C5=C(N4)C=CC(=C5)Br)OS(=O)(=O)[O-])OS(=O)(=O)[O-].[Na+].[Na+] |
Product Overview
RefChem:438648 (CAS 10134-35-7), with molecular formula C20H9BrClNNa2O8S3 and molecular weight 646.81573 g/mol. IUPAC: disodium;[5-bromo-2-(9-chloro-3-sulfonatooxybenzo[g][1]benzothiol-2-yl)-1H-indol-3-yl] sulfate.
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