AC1OA3FE
7-hydroxy-8-[[4-[4-[(2-hydroxy-8-sulfonaphthalen-1-yl)diazenyl]phenyl]sulfonylphenyl]diazenyl]naphthalene-1-sulfonic acid
Also Known As: ethyl 2-methyl-2-isovalerylacetate|NCI60_000499|(8Z)-7-oxo-8-[[4-[4-[(2E)-2-(2-oxo-8-sulfonaphthalen-1-ylide|1-Naphthalenesulfonicacid, 8,8'-[sulfonylbis(p-phenyleneazo)]bis[7-hydroxy- (8CI)|(8Z)-7-oxo-8-[[4-[4-[(2E)-2-(2-oxo-8-sulfonaphthalen-1-ylidene)hydrazinyl]phenyl]sulfonylphenyl]hydrazinylidene]naphthalene-1-sulfonic acid|7-oxo-8-[[4-[4-[2-(2-oxo-8-sulfonaphthalen-1-ylidene)hydrazinyl]phenyl]sulfonylphenyl]hydrazinylidene]naphthalene-1-sulfonic acid
| Molecular Formula | C32H22N4O10S3 |
|---|---|
| Molecular Weight | 718.0498 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 258.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 718.0498 |
| Monoisotopic Mass | 718.0498 |
| Heavy Atoms | 49 |
| Complexity | 1420.0 |
Chemical Identifiers
| CAS Number | 7251-99-2 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)S(=O)(=O)O)C(=C(C=C2)O)N=NC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)N=NC5=C(C=CC6=C5C(=CC=C6)S(=O)(=O)O)O |
| InChIKey | XQDXOBGAFYLUDL-UHFFFAOYSA-N |
Product Overview
AC1OA3FE (CAS 7251-99-2), with molecular formula C32H22N4O10S3 and molecular weight 718.0498 g/mol. IUPAC: 7-hydroxy-8-[[4-[4-[(2-hydroxy-8-sulfonaphthalen-1-yl)diazenyl]phenyl]sulfonylphenyl]diazenyl]naphthalene-1-sulfonic acid.