Basic information
- CAS
85252-32-0- Standard SMILES
O=NN(c1ccc(N=Nc2ccc(S(=O)(=O)[O-])cc2)cc1)c1ccccc1[N+](=O)[O-].[Na+]- InChIKey
IDKOWUHJHMOTPZ-RZLHGTIFSA-M- Molecular formula
- C18H12N5NaO6S
- Average molar mass
- 449.4 g/mol
- Monoisotopic mass
- 449.04059858
Names & identifiers
- Preferred name
- Sodium 4-((4-((nitrophenyl)nitrosoamino)phenyl)azo)benzenesulphonate
- IUPAC
- sodium 4-[[4-(2-nitro-N-nitrosoanilino)phenyl]diazenyl]benzenesulfonate
- English name
- sodium 4-[[4-[(nitrophenyl)nitrosoamino]phenyl]azo]benzenesulphonate
- Molecular formula
- C18H12N5NaO6S
- Molecular weight
- 449.37255
Names & synonyms
85252-32-0EINECS 286-549-9Sodium 4-((4-((nitrophenyl)nitrosoamino)phenyl)azo)benzenesulphonateBenzenesulfonic acid, 4-((4-((nitrophenyl)nitrosoamino)phenyl)azo)-, sodium saltNS00065234sodium 4-[[4-[(nitrophenyl)nitrosoamino]phenyl]azo]benzenesulphonateBenzenesulfonic acid, 4-4-(nitrophenyl)nitrosoaminophenylazo-, sodium salt
Database identifiers
- CAS
85252-32-0- PubChem CID
- 3020587
- EC Number
- 286-549-9
Properties
Computed structural properties
- Topological polar surface area
- 169 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 707
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 Information
Chemical: Benzenesulfonic acid, 4-[[4-[(nitrophenyl)nitrosoamino]phenyl]azo]-, sodium salt
Benzenesulfonic acid, 4-4-(nitrophenyl)nitrosoaminophenylazo-, sodium salt: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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