Basic information
- CAS
72749-80-5- Standard SMILES
Nc1cc2c(cc1S(=O)(=O)[O-])nc1c3cccc(S(=O)(=O)[O-])c3c(Nc3ccccc3)cc1[n+]2-c1ccccc1.[Na+].[Na+]- InChIKey
OKBJQVCCZCGZHD-UHFFFAOYSA-M- Molecular formula
- C28H19N4Na2O6S2+
- Average molar mass
- 617.6 g/mol
- Monoisotopic mass
- 617.05414025
Names & identifiers
- Preferred name
- Benzo[a]phenazinium, 9-amino-7-phenyl-5-(phenylamino)-4,10-disulfo-, inner salt, sodium salt (1:2)
- IUPAC
- disodium;9-amino-5-anilino-7-phenylbenzo[a]phenazin-7-ium-4,10-disulfonate
Names & synonyms
72749-80-5EINECS 276-817-3Benzo(a)phenazinium, 9-amino-7-phenyl-5-(phenylamino)-4,10-disulfo-, inner salt, disodium salt9-Amino-7-phenyl-5-phenylimino-4,10-disulfobenzo(a)phenazine, disodium saltBenzo(a)phenazinium, 9-amino-7-phenyl-5-(phenylamino)-4,10-disulfo-, inner salt, sodium salt (1:2)Benzo(a)phenazinium, 9-amino-7-phenyl-5-(phenylamino)-4,10-disulfo-, hydroxide, inner salt, disodium saltBenzo[a]phenazinium, 9-amino-7-phenyl-5-(phenylamino)-4,10-disulfo-, inner salt, disodium saltBenzo[a]phenazinium, 9-amino-7-phenyl-5-(phenylamino)-4,10-disulfo-, inner salt, sodium salt (1:2)RefChem:118163NS00123273Hydrogen 9-amino-7-phenyl-5-(phenylamino)-4,10-disulphonatobenzo(a)phenazinium, disodium salt
Database identifiers
- CAS
72749-80-5- PubChem CID
- 166298
- EC Number
- 276-817-3
Properties
Computed structural properties
- Topological polar surface area
- 186 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 42
- Formal charge
- 1
- Complexity
- 1,070
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (2016 of 2016) of all reports.
Not Classified
Aggregated GHS information provided per 2016 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Benzo[a]phenazinium, 9-amino-7-phenyl-5-(phenylamino)-4,10-disulfo-, hydroxide, inner salt, disodium salt
REACH registered substance: Hydrogen 9-amino-7-phenyl-5-(phenylamino)-4,10-disulphonatobenzo[a]phenazinium, disodium salt (EC: 276-817-3)
Hazard Classes and CategoriesNot Classified
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzo[a]phenazinium, 9-amino-7-phenyl-5-(phenylamino)-4,10-disulfo-, inner salt, sodium salt (1:2): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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