Basic information
- CAS
72275-95-7- Standard SMILES
Cc1ccc(S(=O)(=O)Oc2ccc(N=Nc3ccc(N=Nc4ccc(Nc5ccc([N+](=O)[O-])cc5S(=O)(=O)[O-])cc4)c4cc(S(=O)(=O)[O-])ccc34)cc2)cc1.[Na+].[Na+]- InChIKey
CEXKQVNVJBGENQ-UHFFFAOYSA-L- Molecular formula
- C35H24N6Na2O11S3
- Average molar mass
- 846.8 g/mol
- Monoisotopic mass
- 846.04605769
Names & identifiers
- Preferred name
- 2-Naphthalenesulfonic acid, 5-(2-(4-(((4-methylphenyl)sulfonyl)oxy)phenyl)diazenyl)-8-(2-(4-((4-nitro-2-sulfophenyl)amino)phenyl)diazenyl)-, sodium salt (1:2)
- IUPAC
- disodium;5-[[4-(4-methylphenyl)sulfonyloxyphenyl]diazenyl]-8-[[4-(4-nitro-2-sulfonatoanilino)phenyl]diazenyl]naphthalene-2-sulfonate
- English name
- disodium 5-[[4-[[(4-methylphenyl)sulphonyl]oxy]phenyl]azo]-8-[[4-[(4-nitro-2-sulphonatophenyl)amino]phenyl]azo]naphthalene-2-sulphonate
- Molecular formula
- C35H24N6Na2O11S3
- Molecular weight
- 846.7732
Names & synonyms
72968-80-0EINECS 277-154-2DTXSID508903172-Naphthalenesulfonic acid, 5-((4-(((4-methylphenyl)sulfonyl)oxy)phenyl)azo)-8-((4-((4-nitro-2-sulfophenyl)amino)phenyl)azo)-, disodium salt2-Naphthalenesulfonic acid, 5-(2-(4-(((4-methylphenyl)sulfonyl)oxy)phenyl)diazenyl)-8-(2-(4-((4-nitro-2-sulfophenyl)amino)phenyl)diazenyl)-, sodium salt (1:2)Naphthalene-2-sulfonic acid, 5-((4-(((4-methylphenyl)sulfonyl)oxy)phenyl)azo)-8-((4-((4-nitro-2-sulfophenyl)amino)phenyl)azo)-, disodium salt2-Naphthalenesulfonic acid, 5-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]azo]-8-[[4-[(4-nitro-2-sulfophenyl)amino]phenyl]azo]-, disodium salt2-Naphthalenesulfonic acid, 5-[2-[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]diazenyl]-8-[2-[4-[(4-nitro-2-sulfophenyl)amino]phenyl]diazenyl]-, sodium salt (1:2)RefChem:88511DTXCID801079248CEXKQVNVJBGENQ-UHFFFAOYSA-LEINECS 276-560-7
Show more names
disodium 5-[[4-[[(4-methylphenyl)sulphonyl]oxy]phenyl]azo]-8-[[4-[(4-nitro-2-sulphonatophenyl)amino]phenyl]azo]naphthalene-2-sulphonate
Properties
Computed structural properties
- Topological polar surface area
- 290 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 9
- Heavy atoms
- 57
- Formal charge
- 0
- Complexity
- 1,660
Physicochemical properties
- EPA Substance Registry System
- 2 · 2-Naphthalenesulfonic acid, 5-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]azo]-8-[[4-[(4-nitro-2-sulfophenyl)amino]phenyl]azo]-, disodium salt (72968-80-0)
- 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.
Hazard information
Regulatory InformationChemical: 2-Naphthalenesulfonic acid, 5-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]azo]-8-[[4-[(4-nitro-2-sulfophenyl)amino]phenyl]azo]-, disodium salt
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Naphthalenesulfonic acid, 5-[2-[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]diazenyl]-8-[2-[4-[(4-nitro-2-sulfophenyl)amino]phenyl]diazenyl]-, sodium salt (1:2): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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