Basic information
- CAS
68084-14-0- Standard SMILES
Nc1ccc(N=Nc2ccc(N=Nc3ccc(NC(=O)C(=O)[O-])cc3)c3cc(S(=O)(=O)[O-])ccc23)c2cc(S(=O)(=O)[O-])ccc12.[Na+].[Na+].[Na+]- InChIKey
GGDIRZQYYPQPJE-UHFFFAOYSA-K- Molecular formula
- C28H17N6Na3O9S2
- Average molar mass
- 714.6 g/mol
- Monoisotopic mass
- 714.01915133
Names & identifiers
- Preferred name
- Acetic acid, 2-((4-(2-(4-(2-(4-amino-7-sulfo-1-naphthalenyl)diazenyl)-7-sulfo-1-naphthalenyl)diazenyl)phenyl)amino)-2-oxo-, sodium salt (1:3)
- IUPAC
- trisodium;2-[4-[[4-[(4-amino-7-sulfonatonaphthalen-1-yl)diazenyl]-7-sulfonatonaphthalen-1-yl]diazenyl]anilino]-2-oxoacetate
- English name
- trisodium [[4-[[4-[(4-amino-7-sulphonato-1-naphthyl)azo]-7-sulphonato-1-naphthyl]azo]phenyl]amino]oxoacetate
- Molecular formula
- C28H17N6Na3O9S2
- Molecular weight
- 714.56869
Names & synonyms
EINECS 268-426-168084-14-0DTXSID90889922Acetic acid, ((4-((4-((4-amino-7-sulfo-1-naphthalenyl)azo)-7-sulfo-1-naphthalenyl)azo)phenyl)amino)oxo-, trisodium salt5-Amino-8-((4-((4-(N-oxalylamino)phenyl)azo)-6-sulfonaphthalenyl)azo)-2-naphthalenesulfonic acid, trisodium saltAcetic acid, 2-((4-(2-(4-(2-(4-amino-7-sulfo-1-naphthalenyl)diazenyl)-7-sulfo-1-naphthalenyl)diazenyl)phenyl)amino)-2-oxo-, sodium salt (1:3)Acetic acid, [[4-[[4-[(4-amino-7-sulfo-1-naphthalenyl)azo]-7-sulfo-1-naphthalenyl]azo]phenyl]amino]oxo-, trisodium saltAcetic acid, 2-[[4-[2-[4-[2-(4-amino-7-sulfo-1-naphthalenyl)diazenyl]-7-sulfo-1-naphthalenyl]diazenyl]phenyl]amino]-2-oxo-, sodium salt (1:3)RefChem:108908DTXCID201035949NS00063316Trisodium ((4-((4-((4-amino-7-sulphonato-1-naphthyl)azo)-7-sulphonato-1-naphthyl)azo)phenyl)amino)oxoacetate
Show more names
trisodium [[4-[[4-[(4-amino-7-sulphonato-1-naphthyl)azo]-7-sulphonato-1-naphthyl]azo]phenyl]amino]oxoacetate
Properties
Computed structural properties
- Topological polar surface area
- 276 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 5
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 1,320
Physicochemical properties
- EPA Substance Registry System
- 4 · Acetic acid, [[4-[[4-[(4-amino-7-sulfo-1-naphthalenyl)azo]-7-sulfo-1-naphthalenyl]azo]phenyl]amino]oxo-, trisodium salt (68084-14-0)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationAcetic acid, 2-[[4-[2-[4-[2-(4-amino-7-sulfo-1-naphthalenyl)diazenyl]-7-sulfo-1-naphthalenyl]diazenyl]phenyl]amino]-2-oxo-, sodium salt (1:3): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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