Registration Dossier
Registration Dossier
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EC number: 287-842-4 | CAS number: 85586-40-9
Reference substances
- IUPAC name:
- 5-(Benzoylamino)-4-hydroxy-3-((1-sulpho-6-((2-(sulphooxy)ethyl)sulphonyl)-2-naphthyl)azo)naphthalene-2,7-disulphonic acid, sodium salt
Inventory
- EC number:
- 287-842-4
- EC name:
- 5-(benzoylamino)-4-hydroxy-3-[[1-sulpho-6-[[2-(sulphooxy)ethyl]sulphonyl]-2-naphthyl]azo]naphthalene-2,7-disulphonic acid, sodium salt
- CAS number:
- 85586-40-9
- CAS number:
- 85586-40-9
Synonyms
- Names:
- Identifier:
- IUPAC name
- 5-(benzoylamino)-4-hydroxy-3-[[1-sulfo-6-[[2-(sulfooxy)ethyl]sulfonyl]-2-naphthyl]azo]naphthalene-2,7-disulfonic acid, sodium salt
- Identifier:
- other: Molecular formula
- C29H23N3O17S5.xNa
Molecular and structural information
- Molecular formula:
- C29H19N3Na4O17S5
C29H23N3O17S5.xNa - Molecular weight:
- 933.738
- SMILES notation:
- [Na+].[Na+].[Na+].[Na+].c1c(c(c(c2c(cc(cc12)S(=O)(=O)[O-])NC(c1ccccc1)=O)O)\N=N\c1c(c2ccc(cc2cc1)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]
- InChl:
- InChI=1/C29H23N3O17S5.4Na/c33-27-25-18(13-20(51(37,38)39)15-23(25)30-29(34)16-4-2-1-3-5-16)14-24(52(40,41)42)26(27)32-31-22-9-6-17-12-19(7-8-21(17)28(22)53(43,44)45)50(35,36)11-10-49-54(46,47)48;;;;/h1-9,12-15,33H,10-11H2,(H,30,34)(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,46,47,48);;;;/q;4*+1/p-4/b32-31+;;;;
- Structural formula:
Related substances
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