Basic information
- CAS
67906-43-8- Standard SMILES
COc1cc(N=Nc2cc(N=Nc3cccc(S(=O)(=O)O)c3)cc3ccc(S(=O)(=O)O)cc23)c2cc(S(=O)(=O)O)ccc2c1[N+]#N.[Cl-]- InChIKey
XWLGGKDRJIXDRR-UHFFFAOYSA-N- Molecular formula
- C27H19ClN6O10S3
- Average molar mass
- 719.1 g/mol
- Monoisotopic mass
- 718.001332
Names & identifiers
- Preferred name
- 2-Methoxy-6-sulpho-4-((7-sulpho-4-((3-sulphophenyl)azo)-1-naphthyl)azo)naphthalene-1-diazonium chloride
- IUPAC
- 2-methoxy-6-sulfo-4-[[7-sulfo-3-[(3-sulfophenyl)diazenyl]naphthalen-1-yl]diazenyl]naphthalene-1-diazonium chloride
Names & synonyms
2-Methoxy-6-sulpho-4-((7-sulpho-4-((3-sulphophenyl)azo)-1-naphthyl)azo)naphthalene-1-diazonium chloride
Database identifiers
- CAS
67906-43-8- PubChem CID
- 106089
Properties
Computed structural properties
- Topological polar surface area
- 275 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 8
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 1,530
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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