| CAS Number | 56120-28-6 |
| Catalog Number | AG00DSS2(AGN-PC-0SKH1T) |
| Chemical Name | 4,4''-(DIAZOAMINO)DIBENZENESULFONIC ACID DISODIUM SALT |
| IUPAC Name | disodium;4-[2-(4-sulfonatophenyl)iminohydrazinyl]benzenesulfonate |
| InChI | InChI=1S/C12H11N3O6S2.2Na/c16-22(17,18)11-5-1-9(2-6-11)13-15-14-10-3-7-12(8-4-10)23(19,20)21;;/h1-8H,(H,13,14)(H,16,17,18)(H,19,20,21);;/q;2*+1/p-2 |
| InChI Key | FYVNMDAIZCXVTO-UHFFFAOYSA-L |
| MDL Number | MFCD02752585 |
| Molecular Formula | C12H9N3Na2O6S2 |
| Molecular Weight | 401.3259 |
| SMILES | O=S(C1=CC=C(/N=N/NC2=CC=C(S(=O)(O[Na])=O)C=C2)C=C1)(O[Na])=O |
| Synonyms | 4,4''-(DIAZOAMINO)DIBENZENESULFONIC ACID DISODIUM SALT,
56120-28-6,
SCHEMBL9155561,
4,4'-(Triazene-1,3-diyl)bis(benzenesulfonic acid sodium) salt,
CCRIS 7444,
FYVNMDAIZCXVTO-UHFFFAOYSA-L,
4,4'-(Diazoamino)dibenzenesulfonic acid, disodium salt,
|
| Complexity | 580 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 400.973g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 9 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 401.319g/mol |
| Monoisotopic Mass | 400.973g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 168A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number