Registration Dossier
Registration Dossier
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EC number: 940-267-9 | CAS number: 1185314-63-9
Reference substances
- IUPAC name:
- disodium 4-amino-6-[(1E)-2-[4-({4-[(1E)-2-(2,4-dihydroxyphenyl)diazen-1-yl]phenyl}sulfamoyl)phenyl]diazen-1-yl]-5-hydroxy-3-[(1E)-2-(4-nitrophenyl)diazen-1-yl]naphthalene-2,7-disulfonate
Inventory
Synonyms
- Names:
- Identifier:
- CAS number
- 1185314-63-9
- Identifier:
- EC number
- 940-267-9
- Identifier:
- IUPAC name
- 2,7-Naphthalenedisulfonic acid, 4-amino-6-[2-[4-[[[4-[2-(2,4-dihydroxyphenyl)diazenyl]phenyl] sulfonyl]amino]phenyl]diazenyl]-5-hydroxy-3-[2-(4-nitrophenyl)diazenyl]-, sodium salt (1:2)
- Identifier:
- IUPAC name
- disodium 4-amino-6-{2-[4-({4-[2-(2,4-dihydroxyphenyl)diazen-1-yl]phenyl}sulfamoyl)phenyl]diazen-1-yl}-5-hydroxy-3-[2-(4-nitrophenyl)diazen-1-yl]naphthalene-2,7-disulfonate
- Identifier:
- Colour Index
- Acid Green 068
- Identifier:
- other: Molecular formula
- C34H23N9Na2O13S3
- Identifier:
- other: SMILES notation
- [Na+].[Na+].Oc6ccc(/N=N/c1ccc(cc1)NS(=O)(=O)c2ccc(cc2)/N=N/c5c(O)c4c(cc(c(/N=N/c3ccc(cc3)N(=O)=O)c4N)S([O-])(=O)=O)cc5S([O-])(=O)=O)c(O)c6
- disodium 4-amino-6-{[4-({4-[(2,4-dihydroxyphenyl)diazenyl]phenyl}sulfamoyl)phenyl]diazenyl}-5-hydroxy-3-[(4-nitrophenyl)diazenyl]naphthalene-2,7-disulfonate
Molecular and structural information
- Molecular formula:
- C34H23N9O13S3Na2
- Molecular weight:
- ca. 907.77
- SMILES notation:
- O=S(C1=C(/N=N/C2=CC=C([N+]([O-])=O)C=C2)C(N)=C3C(O)=C(/N=N/C4=CC=C(S(=O)(NC5=CC=C(/N=N/C6=CC=C(O)C=C6O)C=C5)=O)C=C4)C(S(=O)([O-])=O)=CC3=C1)([O-])=O.[Na+].[Na+]
- InChl:
- 1S/C34H25N9O13S3.2Na/c35-31-30-18(15-28(58(51,52)53)32(31)40-37-20-5-9-23(10-6-20)43(47)48)16-29(59(54,55)56)33(34(30)46)41-38-21-7-12-25(13-8-21)57(49,50)42-22-3-1-19(2-4-22)36-39-26-14-11-24(44)17-27(26)45;;/h1-17,42,44-46H,35H2,(H,51,52,53)(H,54,55,56);;/q;2*+1/p-2/b39-36+,40-37+,41-38+;;
- Structural formula:
Related substances
open allclose all
- Identifier:
- E number
- Identity:
- 940-267-9
- Identifier:
- CAS number
- Identity:
- 1397283-80-5
- Identifier:
- IUPAC name
- Identity:
- 2,7-Naphthalenedisulfonic acid, 4-amino-6-[2-[4-[[[4-[2-(2,4-dihydroxyphenyl)diazenyl]phenyl] sulfonyl]amino]phenyl]diazenyl]-5-hydroxy-3-[2-(4-nitrophenyl)diazenyl]-, sodium salt (1:2)
- Identifier:
- Colour Index
- Identity:
- Acid Green 068
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