AC1NTLI6
4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]diazenyl]-3-hydroxynaphthalene-2,7-disulfonic acid
Also Known As: (4Z)-4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylide|(4Z)-4-(2-{4-[Bis(2-chloroethyl)sulfamoyl]phenyl}hydrazinylidene)-3-oxo-3,4-dihydronaphthalene-2,7-disulfonic acid|4-[[4-[Bis(2-chloroethyl)sulfamoyl]phenyl]diazenyl]-3-hydroxynaphthalene-2,7-disulfonic acid|4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-3-oxonaphthalene-2,7-disulfonic acid
| Molecular Formula | C20H19Cl2N3O9S3 |
|---|---|
| Molecular Weight | 610.96606 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 216.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 610.96606 |
| Monoisotopic Mass | 610.96606 |
| Heavy Atoms | 37 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 65624-35-3 |
|---|---|
| SMILES | C1=CC(=CC=C1N=NC2=C3C=CC(=CC3=CC(=C2O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)N(CCCl)CCCl |
| InChIKey | KZOPFQOGGASJPX-UHFFFAOYSA-N |
Product Overview
AC1NTLI6 (CAS 65624-35-3), with molecular formula C20H19Cl2N3O9S3 and molecular weight 610.96606 g/mol. IUPAC: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]diazenyl]-3-hydroxynaphthalene-2,7-disulfonic acid.
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