Disodium 6-methyl-2'-(4-((4-(6-methyl-7-sulphonatobenzothiazol-2-yl)phenyl)-NNO-azoxy)phenyl)(2,6'-bibenzothiazole)-7-sulphonate
Basic information
- CAS
83930-03-4- Standard SMILES
Cc1ccc2nc(-c3ccc(N=[N+]([O-])c4ccc(-c5nc6ccc(-c7nc8ccc(C)c(S(=O)(=O)[O-])c8s7)cc6s5)cc4)cc3)sc2c1S(=O)(=O)[O-].[Na+].[Na+]- InChIKey
GTWIXFILJDQQAE-GENHSLEVSA-L- Molecular formula
- C35H21N5Na2O7S5
- Average molar mass
- 829.9 g/mol
- Monoisotopic mass
- 828.98399246
Names & identifiers
- Preferred name
- Disodium 6-methyl-2'-(4-((4-(6-methyl-7-sulphonatobenzothiazol-2-yl)phenyl)-NNO-azoxy)phenyl)(2,6'-bibenzothiazole)-7-sulphonate
- IUPAC
- disodium;6-methyl-2-[4-[[[4-[6-(6-methyl-7-sulfonato-1,3-benzothiazol-2-yl)-1,3-benzothiazol-2-yl]phenyl]-oxidoazaniumylidene]amino]phenyl]-1,3-benzothiazole-7-sulfonate
- English name
- disodium 6-methyl-2'-[4-[[4-(6-methyl-7-sulphonatobenzothiazol-2-yl)phenyl]-NNO-azoxy]phenyl][2,6'-bibenzothiazole]-7-sulphonate
- Molecular formula
- C35H21N5Na2O7S5
- Molecular weight
- 829.87508
Names & synonyms
83930-03-4EINECS 281-377-0Disodium 6-methyl-2'-(4-((4-(6-methyl-7-sulphonatobenzothiazol-2-yl)phenyl)-NNO-azoxy)phenyl)(2,6'-bibenzothiazole)-7-sulphonateDTXSID301373885NS00060438[2,6a(2)-Bibenzothiazole]-7-sulfonic acid, 6-methyl-2a(2)-[4-[2-[4-(6-methyl-7-sulfo-2-benzothiazolyl)phenyl]-1-oxidodiazenyl]phenyl]-, sodium salt (1:2)disodium 6-methyl-2'-[4-[[4-(6-methyl-7-sulphonatobenzothiazol-2-yl)phenyl]-NNO-azoxy]phenyl][2,6'-bibenzothiazole]-7-sulphonate6-Methyl-2'-[4-[[4-(6-methyl-7-sodiooxysulfonyl-2-benzothiazolyl)phenyl]-NNO-azoxy]phenyl]-2,6'-bibenzothiazole-7-sulfonic acid sodium salt
Database identifiers
- CAS
83930-03-4- PubChem CID
- 44147604
- DTXSID
DTXSID301373885- EC Number
- 281-377-0
Properties
Computed structural properties
- Topological polar surface area
- 296 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 5
- Heavy atoms
- 54
- Formal charge
- 0
- Complexity
- 1,500
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…