Registration Dossier
Registration Dossier
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EC number: 228-940-9 | CAS number: 6375-55-9
Reference substances
- IUPAC name:
- NA
Inventory
- EC number:
- 228-940-9
- EC name:
- Disodium 4,4'-bis(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-ylazo)-1,1'-biphenyl-2,6'-disulphonate
- CAS number:
- 6375-55-9
- CAS number:
- 6375-55-9
Synonyms
- Names:
- Identifier:
- IUPAC name
- Disodium 4,4'-bis(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-ylazo)-1,1'-biphenyl-2,6'-disulphonate
- Identifier:
- IUPAC name
- [1,1'-Biphenyl]-2,2'-disulfonic acid, 4,4'-bis[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-, sodium salt (1:2)
- Identifier:
- IUPAC name
- disodium 5-[(E)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazen-1-yl]-2-{4-[(E)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazen-1-yl]-2-sulfonatophenyl}benzene-1-sulfonate
- Identifier:
- other: Molecular formula
- C32H26N8O8S2.2Na
- Identifier:
- other: InChl
- InChI=1S/C32H26N8O8S2.2Na/c1-19-29(31(41)39(37-19)23-9-5-3-6-10-23)35-33-21-13-15-25(27(17-21)49(43,44)45)26-16-14-22(18-28(26)50(46,47)48)34-36-30-20(2)38-40(32(30)42)24-11-7-4-8-12-24;;/h3-18,41-42H,1-2H3,(H,43,44,45)(H,46,47,48);;/q;2*+1/p-2/b35-33+,36-34+;;
- Identifier:
- other: SMILES notation
- [Na+].[Na+].CC1=NN(C2C=CC=CC=2)C(=O)C1N=NC1=CC(=C(C=C1)C1=CC=C(C=C1S([O-])(=O)=O)N=NC1C(=O)N(N=C1C)C1C=CC=CC=1)S([O-])(=O)=O
- sodium 4,4'-bis((E)-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazenyl)biphenyl-2,2'-disulfonate
Molecular and structural information
- Molecular formula:
- C32H24N8Na2O8S2
- Molecular weight:
- ca. 758.69
- SMILES notation:
- Oc5n(nc(C)c5/N=N/c1ccc(c(c1)S(=O)(=O)O[Na])c2ccc(cc2S(=O)(=O)O[Na])/N=N/c3c(O)n(nc3C)c4ccccc4)c6ccccc6
- InChl:
- InChI=1/C32H26N8O8S2.2Na/c1-19-29(31(41)39(37-19)23-9-5-3-6-10-23)35-33-21-13-15-25(27(17-21)49(43,44)45)26-16-14-22(18-28(26)50(46,47)48)34-36-30-20(2)38-40(32(30)42)24-11-7-4-8-12-24;;/h3-18,41-42H,1-2H3,(H,43,44,45)(H,46,47,48);;/q;2*+1/p-2/b35-33+,36-34+;;
- Structural formula:
Related substances
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